[4-[(4-chlorophenyl)-phenyl-methyl]piperazin-1-yl]-(1-thiophen-2-ylsulfonylpiperidin-3-yl)methanone

Systemtic Name: [4-[(4-chlorophenyl)-phenyl-methyl]piperazin-1-yl]-(1-thiophen-2-ylsulfonylpiperidin-3-yl)methanone Openeye Name: [4-[(4-chlorophenyl)-phenyl-methyl]piperazin-1-yl]-[1-(2-thienylsulfonyl)-3-piperidyl]methanone CAS Name: [4-[(4-chlorophenyl)-phenylmethyl]-1-piperazinyl]-(1-thiophen-2-ylsulfonyl-3-piperidinyl)methanone IUPAC Name: [4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]-(1-thiophen-2-ylsulfonylpiperidin-3-yl)methanone Traditional Name: [4-[(4-chlorophenyl)-phenyl-methyl]piperazino]-[1-(2-thienylsulfonyl)-3-piperidyl]methanone Formula: C27H30ClN3O3S2 MolecularWeight: 544.1284

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CS2)C(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=CS2)C(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C27H30ClN3O3S2/c28-24-12-10-22(11-13-24)26(21-6-2-1-3-7-21)29-15-17-30(18-16-29)27(32)23-8-4-14-31(20-23)36(33,34)25-9-5-19-35-25/h1-3,5-7,9-13,19,23,26H,4,8,14-18,20H2