CHEBI:121504 - 1-[3-[(7-cyano-[1,3]dioxolo[4,5-g]quinolin-6-yl)amino]propyl]-3-(3-methoxypropyl)thiourea

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 1-[3-[(7-cyano-[1,3]dioxolo[4,5-g]quinolin-6-yl)amino]propyl]-3-(3-methoxypropyl)thiourea
ChEBI ID CHEBI:121504
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C19H23N5O3S
Net Charge 0
Average Mass 401.484
Monoisotopic Mass 401.15216
InChI InChI=1S/C19H23N5O3S/c1-25-7-3-6-23-19(28)22-5-2-4-21-18-14(11-20)8-13-9-16-17(27-12-26-16)10-15(13)24-18/h8-10H,2-7,12H2,1H3,(H,21,24)(H2,22,23,28)
InChIKey ODSGMEMXLCTXCA-UHFFFAOYSA-N
SMILES COCCCNC(=S)NCCCNC1=NC2=CC3=C(C=C2C=C1C#N)OCO3
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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ChEBI Ontology
Outgoing 1-[3-[(7-cyano-[1,3]dioxolo[4,5-g]quinolin-6-yl)amino]propyl]-3-(3-methoxypropyl)thiourea (CHEBI:121504) is a aminoquinoline (CHEBI:36709)
Manual Xref Database
LSM-32947 LINCS
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