5-bromanyl-N-[1-[3-methyl-4-(2-pyridin-3-ylpiperidin-1-yl)carbonyl-phenyl]-5-oxidanylidene-pyrrolidin-3-yl]thiophene-2-carboxamide

Systemtic Name: 5-bromanyl-N-[1-[3-methyl-4-(2-pyridin-3-ylpiperidin-1-yl)carbonyl-phenyl]-5-oxidanylidene-pyrrolidin-3-yl]thiophene-2-carboxamide Openeye Name: 5-bromo-N-[1-[3-methyl-4-[2-(3-pyridyl)piperidine-1-carbonyl]phenyl]-5-oxo-pyrrolidin-3-yl]thiophene-2-carboxamide CAS Name: 5-bromo-N-[1-[3-methyl-4-[oxo-[2-(3-pyridinyl)-1-piperidinyl]methyl]phenyl]-5-oxo-3-pyrrolidinyl]-2-thiophenecarboxamide IUPAC Name: 5-bromo-N-[1-[3-methyl-4-(2-pyridin-3-ylpiperidine-1-carbonyl)phenyl]-5-oxopyrrolidin-3-yl]thiophene-2-carboxamide Traditional Name: 5-bromo-N-[5-keto-1-[3-methyl-4-[2-(3-pyridyl)piperidine-1-carbonyl]phenyl]pyrrolidin-3-yl]thiophene-2-carboxamide Formula: C27H27BrN4O3S MolecularWeight: 567.49728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CC(CC2=O)NC(=O)C3=CC=C(S3)Br)C(=O)N4CCCCC4C5=CN=CC=C5

Isomeric SMILES

CC1=C(C=CC(=C1)N2CC(CC2=O)NC(=O)C3=CC=C(S3)Br)C(=O)N4CCCCC4C5=CN=CC=C5

InChI

InChI=1S/C27H27BrN4O3S/c1-17-13-20(32-16-19(14-25(32)33)30-26(34)23-9-10-24(28)36-23)7-8-21(17)27(35)31-12-3-2-6-22(31)18-5-4-11-29-15-18/h4-5,7-11,13,15,19,22H,2-3,6,12,14,16H2,1H3,(H,30,34)