[2-(4-methylpiperazin-1-yl)-4-(4-phenylpiperidin-1-yl)-5-piperidin-1-ylsulfonyl-phenyl]-piperidin-1-yl-methanone

Systemtic Name: [2-(4-methylpiperazin-1-yl)-4-(4-phenylpiperidin-1-yl)-5-piperidin-1-ylsulfonyl-phenyl]-piperidin-1-yl-methanone Openeye Name: [2-(4-methylpiperazin-1-yl)-4-(4-phenyl-1-piperidyl)-5-(1-piperidylsulfonyl)phenyl]-(1-piperidyl)methanone CAS Name: [2-(4-methyl-1-piperazinyl)-4-(4-phenyl-1-piperidinyl)-5-(1-piperidinylsulfonyl)phenyl]-(1-piperidinyl)methanone IUPAC Name: [2-(4-methylpiperazin-1-yl)-4-(4-phenylpiperidin-1-yl)-5-piperidin-1-ylsulfonylphenyl]-piperidin-1-ylmethanone Traditional Name: [2-(4-methylpiperazino)-4-(4-phenylpiperidino)-5-piperidinosulfonyl-phenyl]-piperidino-methanone Formula: C33H47N5O3S MolecularWeight: 593.82298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC(=C(C=C2C(=O)N3CCCCC3)S(=O)(=O)N4CCCCC4)N5CCC(CC5)C6=CC=CC=C6

Isomeric SMILES

CN1CCN(CC1)C2=CC(=C(C=C2C(=O)N3CCCCC3)S(=O)(=O)N4CCCCC4)N5CCC(CC5)C6=CC=CC=C6

InChI

InChI=1S/C33H47N5O3S/c1-34-21-23-36(24-22-34)30-26-31(35-19-13-28(14-20-35)27-11-5-2-6-12-27)32(42(40,41)38-17-9-4-10-18-38)25-29(30)33(39)37-15-7-3-8-16-37/h2,5-6,11-12,25-26,28H,3-4,7-10,13-24H2,1H3