(4-ethylphenyl)-[4-(4-methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)carbonylpiperazin-1-yl]methanone

Systemtic Name: (4-ethylphenyl)-[4-(4-methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)carbonylpiperazin-1-yl]methanone Openeye Name: (4-ethylphenyl)-[4-(4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzoyl)piperazin-1-yl]methanone CAS Name: (4-ethylphenyl)-[4-[[4-methoxy-3-(1-pyrrolidinylsulfonyl)phenyl]-oxomethyl]-1-piperazinyl]methanone IUPAC Name: (4-ethylphenyl)-[4-(4-methoxy-3-pyrrolidin-1-ylsulfonylbenzoyl)piperazin-1-yl]methanone Traditional Name: (4-ethylphenyl)-[4-(4-methoxy-3-pyrrolidinosulfonyl-benzoyl)piperazino]methanone Formula: C25H31N3O5S MolecularWeight: 485.59574

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CC(=C(C=C3)OC)S(=O)(=O)N4CCCC4

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CC(=C(C=C3)OC)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C25H31N3O5S/c1-3-19-6-8-20(9-7-19)24(29)26-14-16-27(17-15-26)25(30)21-10-11-22(33-2)23(18-21)34(31,32)28-12-4-5-13-28/h6-11,18H,3-5,12-17H2,1-2H3