2-(1H-benzimidazol-2-ylsulfanyl)-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]ethanamide

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]ethanamide Openeye Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]acetamide CAS Name: 2-(1H-benzimidazol-2-ylthio)-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]acetamide IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]acetamide Traditional Name: 2-(1H-benzimidazol-2-ylthio)-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]acetamide Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)CNC(=O)CSC3=NC4=CC=CC=C4N3

Isomeric SMILES

C1[C@@H](OC2=CC=CC=C2O1)CNC(=O)CSC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C18H17N3O3S/c22-17(11-25-18-20-13-5-1-2-6-14(13)21-18)19-9-12-10-23-15-7-3-4-8-16(15)24-12/h1-8,12H,9-11H2,(H,19,22)(H,20,21)/t12-/m0/s1