N-(benzimidazol-1-yl)-4-(2,3,5,6-tetramethylphenyl)sulfonyl-piperazine-1-carboxamide

Systemtic Name: N-(benzimidazol-1-yl)-4-(2,3,5,6-tetramethylphenyl)sulfonyl-piperazine-1-carboxamide Openeye Name: N-(benzimidazol-1-yl)-4-(2,3,5,6-tetramethylphenyl)sulfonyl-piperazine-1-carboxamide CAS Name: N-(1-benzimidazolyl)-4-(2,3,5,6-tetramethylphenyl)sulfonyl-1-piperazinecarboxamide IUPAC Name: N-(benzimidazol-1-yl)-4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazine-1-carboxamide Traditional Name: N-(benzimidazol-1-yl)-4-(2,3,5,6-tetramethylphenyl)sulfonyl-piperazine-1-carboxamide Formula: C22H27N5O3S MolecularWeight: 441.54648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCN(CC2)C(=O)NN3C=NC4=CC=CC=C43)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCN(CC2)C(=O)NN3C=NC4=CC=CC=C43)C)C

InChI

InChI=1S/C22H27N5O3S/c1-15-13-16(2)18(4)21(17(15)3)31(29,30)26-11-9-25(10-12-26)22(28)24-27-14-23-19-7-5-6-8-20(19)27/h5-8,13-14H,9-12H2,1-4H3,(H,24,28)