(4-ethylphenyl)-[4-(4-pyrrolidin-1-ylsulfonylphenyl)carbonylpiperazin-1-yl]methanone

Systemtic Name: (4-ethylphenyl)-[4-(4-pyrrolidin-1-ylsulfonylphenyl)carbonylpiperazin-1-yl]methanone Openeye Name: (4-ethylphenyl)-[4-(4-pyrrolidin-1-ylsulfonylbenzoyl)piperazin-1-yl]methanone CAS Name: (4-ethylphenyl)-[4-[oxo-[4-(1-pyrrolidinylsulfonyl)phenyl]methyl]-1-piperazinyl]methanone IUPAC Name: (4-ethylphenyl)-[4-(4-pyrrolidin-1-ylsulfonylbenzoyl)piperazin-1-yl]methanone Traditional Name: (4-ethylphenyl)-[4-(4-pyrrolidinosulfonylbenzoyl)piperazino]methanone Formula: C24H29N3O4S MolecularWeight: 455.56976

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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)S(=O)(=O)N4CCCC4

Isomeric SMILES

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

InChI

InChI=1S/C24H29N3O4S/c1-2-19-5-7-20(8-6-19)23(28)25-15-17-26(18-16-25)24(29)21-9-11-22(12-10-21)32(30,31)27-13-3-4-14-27/h5-12H,2-4,13-18H2,1H3