N-[4-[(2R)-2-(1-methylbenzimidazol-2-yl)sulfanylpropanoyl]phenyl]methanesulfonamide

Systemtic Name: N-[4-[(2R)-2-(1-methylbenzimidazol-2-yl)sulfanylpropanoyl]phenyl]methanesulfonamide Openeye Name: N-[4-[(2R)-2-(1-methylbenzimidazol-2-yl)sulfanylpropanoyl]phenyl]methanesulfonamide CAS Name: N-[4-[(2R)-2-[(1-methyl-2-benzimidazolyl)thio]-1-oxopropyl]phenyl]methanesulfonamide IUPAC Name: N-[4-[(2R)-2-(1-methylbenzimidazol-2-yl)sulfanylpropanoyl]phenyl]methanesulfonamide Traditional Name: N-[4-[(2R)-2-[(1-methylbenzimidazol-2-yl)thio]propanoyl]phenyl]methanesulfonamide Formula: C18H19N3O3S2 MolecularWeight: 389.49176

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=C(C=C1)NS(=O)(=O)C)SC2=NC3=CC=CC=C3N2C

Isomeric SMILES

C[C@H](C(=O)C1=CC=C(C=C1)NS(=O)(=O)C)SC2=NC3=CC=CC=C3N2C

InChI

InChI=1S/C18H19N3O3S2/c1-12(25-18-19-15-6-4-5-7-16(15)21(18)2)17(22)13-8-10-14(11-9-13)20-26(3,23)24/h4-12,20H,1-3H3/t12-/m1/s1