(2R)-N-(1,3-benzodioxol-5-yl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-propanamide

Systemtic Name: (2R)-N-(1,3-benzodioxol-5-yl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-propanamide Openeye Name: (2R)-N-(1,3-benzodioxol-5-yl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-propanamide CAS Name: (2R)-N-(1,3-benzodioxol-5-yl)-2-[(1-methyl-2-benzimidazolyl)thio]propanamide IUPAC Name: (2R)-N-(1,3-benzodioxol-5-yl)-2-(1-methylbenzimidazol-2-yl)sulfanylpropanamide Traditional Name: (2R)-N-(1,3-benzodioxol-5-yl)-2-[(1-methylbenzimidazol-2-yl)thio]propionamide Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)OCO2)SC3=NC4=CC=CC=C4N3C

Isomeric SMILES

C[C@H](C(=O)NC1=CC2=C(C=C1)OCO2)SC3=NC4=CC=CC=C4N3C

InChI

InChI=1S/C18H17N3O3S/c1-11(25-18-20-13-5-3-4-6-14(13)21(18)2)17(22)19-12-7-8-15-16(9-12)24-10-23-15/h3-9,11H,10H2,1-2H3,(H,19,22)/t11-/m1/s1