Chemical Components in the PDB

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P2Z : Summary

Code

P2Z

One-letter code

X

Molecule name

Promazine

Synonyms

N,N-dimethyl-3-(10H-phenothiazin-10-yl)propan-1-amine

Systematic names

ProgramVersionName
ACDLabs 12.01 N,N-dimethyl-3-(10H-phenothiazin-10-yl)propan-1-amine
OpenEye OEToolkits 1.7.6 N,N-dimethyl-3-phenothiazin-10-yl-propan-1-amine

Formula

C17 H20 N2 S

Formal charge

0

Molecular weight

284.419 Da

SMILES

TypeProgramVersionDescriptor
SMILES ACDLabs 12.01 S2c1ccccc1N(c3c2cccc3)CCCN(C)C
SMILES CACTVS 3.385 CN(C)CCCN1c2ccccc2Sc3ccccc13
SMILES OpenEye OEToolkits 1.7.6 CN(C)CCCN1c2ccccc2Sc3c1cccc3
Canonical SMILES CACTVS 3.385 CN(C)CCCN1c2ccccc2Sc3ccccc13
Canonical SMILES OpenEye OEToolkits 1.7.6 CN(C)CCCN1c2ccccc2Sc3c1cccc3

IUPAC InChI

InChI=1S/C17H20N2S/c1-18(2)12-7-13-19-14-8-3-5-10-16(14)20-17-11-6-4-9-15(17)19/h3-6,8-11H,7,12-13H2,1-2H3

IUPAC InChI key

ZGUGWUXLJSTTMA-UHFFFAOYSA-N
P2Z

wwPDB Information

Atom count

40 (20 without Hydrogen)

Polymer type

Bound ligand

Type description

NON-POLYMER

Type code

HETAIN

Is modified

No

Standard parent

Not Assigned

Defined at

2013-08-23

Last modified at

2020-06-17

Status

Released

Obsoleted

Not Assigned