[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-(3-pyrrolidin-1-ylsulfonylthiophen-2-yl)methanone

Systemtic Name: [4-[(3-chlorophenyl)methyl]piperazin-1-yl]-(3-pyrrolidin-1-ylsulfonylthiophen-2-yl)methanone Openeye Name: [4-[(3-chlorophenyl)methyl]piperazin-1-yl]-(3-pyrrolidin-1-ylsulfonyl-2-thienyl)methanone CAS Name: [4-[(3-chlorophenyl)methyl]-1-piperazinyl]-[3-(1-pyrrolidinylsulfonyl)-2-thiophenyl]methanone IUPAC Name: [4-[(3-chlorophenyl)methyl]piperazin-1-yl]-(3-pyrrolidin-1-ylsulfonylthiophen-2-yl)methanone Traditional Name: [4-(3-chlorobenzyl)piperazino]-(3-pyrrolidinosulfonyl-2-thienyl)methanone Formula: C20H24ClN3O3S2 MolecularWeight: 454.00586

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(SC=C2)C(=O)N3CCN(CC3)CC4=CC(=CC=C4)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(SC=C2)C(=O)N3CCN(CC3)CC4=CC(=CC=C4)Cl

InChI

InChI=1S/C20H24ClN3O3S2/c21-17-5-3-4-16(14-17)15-22-9-11-23(12-10-22)20(25)19-18(6-13-28-19)29(26,27)24-7-1-2-8-24/h3-6,13-14H,1-2,7-12,15H2