(4-methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone

Systemtic Name: (4-methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone Openeye Name: (4-methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-[4-(2-thienylsulfonyl)piperazin-1-yl]methanone CAS Name: [4-methoxy-3-(1-pyrrolidinylsulfonyl)phenyl]-(4-thiophen-2-ylsulfonyl-1-piperazinyl)methanone IUPAC Name: (4-methoxy-3-pyrrolidin-1-ylsulfonylphenyl)-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone Traditional Name: (4-methoxy-3-pyrrolidinosulfonyl-phenyl)-[4-(2-thienylsulfonyl)piperazino]methanone Formula: C20H25N3O6S3 MolecularWeight: 499.624

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CS3)S(=O)(=O)N4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CS3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C20H25N3O6S3/c1-29-17-7-6-16(15-18(17)31(25,26)22-8-2-3-9-22)20(24)21-10-12-23(13-11-21)32(27,28)19-5-4-14-30-19/h4-7,14-15H,2-3,8-13H2,1H3