N-[(4-methylsulfonylphenyl)methyl]-4,5,6,7-tetrahydro-3H-benzimidazole-5-carboxamide

Systemtic Name: N-[(4-methylsulfonylphenyl)methyl]-4,5,6,7-tetrahydro-3H-benzimidazole-5-carboxamide Openeye Name: N-[(4-methylsulfonylphenyl)methyl]-4,5,6,7-tetrahydro-3H-benzimidazole-5-carboxamide CAS Name: N-[(4-methylsulfonylphenyl)methyl]-4,5,6,7-tetrahydro-3H-benzimidazole-5-carboxamide IUPAC Name: N-[(4-methylsulfonylphenyl)methyl]-4,5,6,7-tetrahydro-3H-benzimidazole-5-carboxamide Traditional Name: N-(4-mesylbenzyl)-4,5,6,7-tetrahydro-3H-benzimidazole-5-carboxamide Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)CNC(=O)C2CCC3=C(C2)NC=N3

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)CNC(=O)C2CCC3=C(C2)NC=N3

InChI

InChI=1S/C16H19N3O3S/c1-23(21,22)13-5-2-11(3-6-13)9-17-16(20)12-4-7-14-15(8-12)19-10-18-14/h2-3,5-6,10,12H,4,7-9H2,1H3,(H,17,20)(H,18,19)