N-[3-(1H-benzimidazol-2-yl)propyl]-4-(2,4,6-trimethylphenyl)sulfonyl-piperazine-1-carboxamide

Systemtic Name: N-[3-(1H-benzimidazol-2-yl)propyl]-4-(2,4,6-trimethylphenyl)sulfonyl-piperazine-1-carboxamide Openeye Name: N-[3-(1H-benzimidazol-2-yl)propyl]-4-(2,4,6-trimethylphenyl)sulfonyl-piperazine-1-carboxamide CAS Name: N-[3-(1H-benzimidazol-2-yl)propyl]-4-(2,4,6-trimethylphenyl)sulfonyl-1-piperazinecarboxamide IUPAC Name: N-[3-(1H-benzimidazol-2-yl)propyl]-4-(2,4,6-trimethylphenyl)sulfonylpiperazine-1-carboxamide Traditional Name: N-[3-(1H-benzimidazol-2-yl)propyl]-4-mesitylsulfonyl-piperazine-1-carboxamide Formula: C24H31N5O3S MolecularWeight: 469.59964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)NCCCC3=NC4=CC=CC=C4N3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)NCCCC3=NC4=CC=CC=C4N3)C

InChI

InChI=1S/C24H31N5O3S/c1-17-15-18(2)23(19(3)16-17)33(31,32)29-13-11-28(12-14-29)24(30)25-10-6-9-22-26-20-7-4-5-8-21(20)27-22/h4-5,7-8,15-16H,6,9-14H2,1-3H3,(H,25,30)(H,26,27)