N-(1H-benzimidazol-2-yl)-4-(4-methylsulfonylpiperazin-1-yl)-4-oxidanylidene-butanamide

Systemtic Name: N-(1H-benzimidazol-2-yl)-4-(4-methylsulfonylpiperazin-1-yl)-4-oxidanylidene-butanamide Openeye Name: N-(1H-benzimidazol-2-yl)-4-(4-methylsulfonylpiperazin-1-yl)-4-oxo-butanamide CAS Name: N-(1H-benzimidazol-2-yl)-4-(4-methylsulfonyl-1-piperazinyl)-4-oxobutanamide IUPAC Name: N-(1H-benzimidazol-2-yl)-4-(4-methylsulfonylpiperazin-1-yl)-4-oxobutanamide Traditional Name: N-(1H-benzimidazol-2-yl)-4-keto-4-(4-mesylpiperazino)butyramide Formula: C16H21N5O4S MolecularWeight: 379.43404

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C(=O)CCC(=O)NC2=NC3=CC=CC=C3N2

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C(=O)CCC(=O)NC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C16H21N5O4S/c1-26(24,25)21-10-8-20(9-11-21)15(23)7-6-14(22)19-16-17-12-4-2-3-5-13(12)18-16/h2-5H,6-11H2,1H3,(H2,17,18,19,22)