[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)methanone

Systemtic Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)methanone Openeye Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)methanone CAS Name: [4-(4-bromophenyl)sulfonyl-1-piperazinyl]-(1-ethyl-2,5-dimethyl-3-pyrrolyl)methanone IUPAC Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-(1-ethyl-2,5-dimethylpyrrol-3-yl)methanone Traditional Name: (4-brosylpiperazino)-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)methanone Formula: C19H24BrN3O3S MolecularWeight: 454.38116

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=C1C)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br)C

Isomeric SMILES

CCN1C(=CC(=C1C)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br)C

InChI

InChI=1S/C19H24BrN3O3S/c1-4-23-14(2)13-18(15(23)3)19(24)21-9-11-22(12-10-21)27(25,26)17-7-5-16(20)6-8-17/h5-8,13H,4,9-12H2,1-3H3