[4-(4-bromanyl-3-methyl-phenyl)sulfonylpiperazin-1-yl]-(4-pyrrol-1-ylphenyl)methanone

Systemtic Name: [4-(4-bromanyl-3-methyl-phenyl)sulfonylpiperazin-1-yl]-(4-pyrrol-1-ylphenyl)methanone Openeye Name: [4-(4-bromo-3-methyl-phenyl)sulfonylpiperazin-1-yl]-(4-pyrrol-1-ylphenyl)methanone CAS Name: [4-(4-bromo-3-methylphenyl)sulfonyl-1-piperazinyl]-[4-(1-pyrrolyl)phenyl]methanone IUPAC Name: [4-(4-bromo-3-methylphenyl)sulfonylpiperazin-1-yl]-(4-pyrrol-1-ylphenyl)methanone Traditional Name: [4-(4-bromo-3-methyl-phenyl)sulfonylpiperazino]-(4-pyrrol-1-ylphenyl)methanone Formula: C22H22BrN3O3S MolecularWeight: 488.39738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)N4C=CC=C4)Br

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)N4C=CC=C4)Br

InChI

InChI=1S/C22H22BrN3O3S/c1-17-16-20(8-9-21(17)23)30(28,29)26-14-12-25(13-15-26)22(27)18-4-6-19(7-5-18)24-10-2-3-11-24/h2-11,16H,12-15H2,1H3