(4-methyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: (4-methyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-(4-phenylpiperazin-1-yl)methanone Openeye Name: (4-methyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-(4-phenylpiperazin-1-yl)methanone CAS Name: [4-methyl-3-(1-pyrrolidinylsulfonyl)phenyl]-(4-phenyl-1-piperazinyl)methanone IUPAC Name: (4-methyl-3-pyrrolidin-1-ylsulfonylphenyl)-(4-phenylpiperazin-1-yl)methanone Traditional Name: (4-methyl-3-pyrrolidinosulfonyl-phenyl)-(4-phenylpiperazino)methanone Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=CC=CC=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=CC=CC=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C22H27N3O3S/c1-18-9-10-19(17-21(18)29(27,28)25-11-5-6-12-25)22(26)24-15-13-23(14-16-24)20-7-3-2-4-8-20/h2-4,7-10,17H,5-6,11-16H2,1H3