(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-[4-(thiophen-2-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: (4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-[4-(thiophen-2-ylmethyl)piperazin-1-yl]methanone Openeye Name: (4-chloro-3-pyrrolidin-1-ylsulfonyl-phenyl)-[4-(2-thienylmethyl)piperazin-1-yl]methanone CAS Name: [4-chloro-3-(1-pyrrolidinylsulfonyl)phenyl]-[4-(thiophen-2-ylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-chloro-3-pyrrolidin-1-ylsulfonylphenyl)-[4-(thiophen-2-ylmethyl)piperazin-1-yl]methanone Traditional Name: (4-chloro-3-pyrrolidinosulfonyl-phenyl)-[4-(2-thenyl)piperazino]methanone Formula: C20H24ClN3O3S2 MolecularWeight: 454.00586

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CCN(CC3)CC4=CC=CS4)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CCN(CC3)CC4=CC=CS4)Cl

InChI

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