1-(4-bromanyl-3-methyl-phenyl)-4-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)carbonyl-pyrrolidin-2-one

Systemtic Name: 1-(4-bromanyl-3-methyl-phenyl)-4-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)carbonyl-pyrrolidin-2-one Openeye Name: 1-(4-bromo-3-methyl-phenyl)-4-(4-pyrrolidin-1-ylsulfonylpiperazine-1-carbonyl)pyrrolidin-2-one CAS Name: 1-(4-bromo-3-methylphenyl)-4-[oxo-[4-(1-pyrrolidinylsulfonyl)-1-piperazinyl]methyl]-2-pyrrolidinone IUPAC Name: 1-(4-bromo-3-methylphenyl)-4-(4-pyrrolidin-1-ylsulfonylpiperazine-1-carbonyl)pyrrolidin-2-one Traditional Name: 1-(4-bromo-3-methyl-phenyl)-4-(4-pyrrolidinosulfonylpiperazine-1-carbonyl)-2-pyrrolidone Formula: C20H27BrN4O4S MolecularWeight: 499.42178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CC(CC2=O)C(=O)N3CCN(CC3)S(=O)(=O)N4CCCC4)Br

Isomeric SMILES

CC1=C(C=CC(=C1)N2CC(CC2=O)C(=O)N3CCN(CC3)S(=O)(=O)N4CCCC4)Br

InChI

InChI=1S/C20H27BrN4O4S/c1-15-12-17(4-5-18(15)21)25-14-16(13-19(25)26)20(27)22-8-10-24(11-9-22)30(28,29)23-6-2-3-7-23/h4-5,12,16H,2-3,6-11,13-14H2,1H3