1-[2-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]carbonylphenyl]pyrrolidin-2-one

Systemtic Name: 1-[2-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]carbonylphenyl]pyrrolidin-2-one Openeye Name: 1-[2-[4-[(5-bromo-2-thienyl)sulfonyl]piperazine-1-carbonyl]phenyl]pyrrolidin-2-one CAS Name: 1-[2-[[4-[(5-bromo-2-thiophenyl)sulfonyl]-1-piperazinyl]-oxomethyl]phenyl]-2-pyrrolidinone IUPAC Name: 1-[2-[4-(5-bromothiophen-2-yl)sulfonylpiperazine-1-carbonyl]phenyl]pyrrolidin-2-one Traditional Name: 1-[2-[4-[(5-bromo-2-thienyl)sulfonyl]piperazine-1-carbonyl]phenyl]-2-pyrrolidone Formula: C19H20BrN3O4S2 MolecularWeight: 498.4138

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=CC=C2C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(S4)Br

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=CC=C2C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(S4)Br

InChI

InChI=1S/C19H20BrN3O4S2/c20-16-7-8-18(28-16)29(26,27)22-12-10-21(11-13-22)19(25)14-4-1-2-5-15(14)23-9-3-6-17(23)24/h1-2,4-5,7-8H,3,6,9-13H2