2-(1H-benzimidazol-2-ylsulfanyl)-N-(1,3-benzodioxol-5-ylmethyl)propanamide

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-(1,3-benzodioxol-5-ylmethyl)propanamide Openeye Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-(1,3-benzodioxol-5-ylmethyl)propanamide CAS Name: 2-(1H-benzimidazol-2-ylthio)-N-(1,3-benzodioxol-5-ylmethyl)propanamide IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-(1,3-benzodioxol-5-ylmethyl)propanamide Traditional Name: 2-(1H-benzimidazol-2-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=NC4=CC=CC=C4N3

Isomeric SMILES

CC(C(=O)NCC1=CC2=C(C=C1)OCO2)SC3=NC4=CC=CC=C4N3

InChI

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