N-(2-ethyl-6-methyl-phenyl)-4-piperidin-1-yl-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-4-piperidin-1-yl-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-(2-ethyl-6-methyl-phenyl)-4-(1-piperidyl)-3-(1-piperidylsulfonyl)benzamide CAS Name: N-(2-ethyl-6-methylphenyl)-4-(1-piperidinyl)-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-(2-ethyl-6-methylphenyl)-4-piperidin-1-yl-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-(2-ethyl-6-methyl-phenyl)-4-piperidino-3-piperidinosulfonyl-benzamide Formula: C26H35N3O3S MolecularWeight: 469.6394

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C2=CC(=C(C=C2)N3CCCCC3)S(=O)(=O)N4CCCCC4)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C2=CC(=C(C=C2)N3CCCCC3)S(=O)(=O)N4CCCCC4)C

InChI

InChI=1S/C26H35N3O3S/c1-3-21-12-10-11-20(2)25(21)27-26(30)22-13-14-23(28-15-6-4-7-16-28)24(19-22)33(31,32)29-17-8-5-9-18-29/h10-14,19H,3-9,15-18H2,1-2H3,(H,27,30)