N-(1,3-benzodioxol-5-ylmethyl)-2-imidazo[1,5-a]pyridin-3-ylsulfanyl-propanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-imidazo[1,5-a]pyridin-3-ylsulfanyl-propanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-imidazo[1,5-a]pyridin-3-ylsulfanyl-propanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3-imidazo[1,5-a]pyridinylthio)propanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-imidazo[1,5-a]pyridin-3-ylsulfanylpropanamide Traditional Name: 2-(imidazo[1,5-a]pyridin-3-ylthio)-N-piperonyl-propionamide Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC2=C(C=C1)OCO2)SC3=NC=C4N3C=CC=C4

Isomeric SMILES

CC(C(=O)NCC1=CC2=C(C=C1)OCO2)SC3=NC=C4N3C=CC=C4

InChI

InChI=1S/C18H17N3O3S/c1-12(25-18-20-10-14-4-2-3-7-21(14)18)17(22)19-9-13-5-6-15-16(8-13)24-11-23-15/h2-8,10,12H,9,11H2,1H3,(H,19,22)