N-[1-(4-fluorophenyl)carbonyl-5-piperazin-1-ylcarbonyl-pyrrolidin-3-yl]-N-[(3-methoxyphenyl)methyl]thiophene-2-carboxamide

Systemtic Name: N-[1-(4-fluorophenyl)carbonyl-5-piperazin-1-ylcarbonyl-pyrrolidin-3-yl]-N-[(3-methoxyphenyl)methyl]thiophene-2-carboxamide Openeye Name: N-[1-(4-fluorobenzoyl)-5-(piperazine-1-carbonyl)pyrrolidin-3-yl]-N-[(3-methoxyphenyl)methyl]thiophene-2-carboxamide CAS Name: N-[1-[(4-fluorophenyl)-oxomethyl]-5-[oxo(1-piperazinyl)methyl]-3-pyrrolidinyl]-N-[(3-methoxyphenyl)methyl]-2-thiophenecarboxamide IUPAC Name: N-[1-(4-fluorobenzoyl)-5-(piperazine-1-carbonyl)pyrrolidin-3-yl]-N-[(3-methoxyphenyl)methyl]thiophene-2-carboxamide Traditional Name: N-[1-(4-fluorobenzoyl)-5-(piperazine-1-carbonyl)pyrrolidin-3-yl]-N-m-anisyl-thiophene-2-carboxamide Formula: C29H31FN4O4S MolecularWeight: 550.644243

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN(C2CC(N(C2)C(=O)C3=CC=C(C=C3)F)C(=O)N4CCNCC4)C(=O)C5=CC=CS5

Isomeric SMILES

COC1=CC=CC(=C1)CN(C2CC(N(C2)C(=O)C3=CC=C(C=C3)F)C(=O)N4CCNCC4)C(=O)C5=CC=CS5

InChI

InChI=1S/C29H31FN4O4S/c1-38-24-5-2-4-20(16-24)18-33(29(37)26-6-3-15-39-26)23-17-25(28(36)32-13-11-31-12-14-32)34(19-23)27(35)21-7-9-22(30)10-8-21/h2-10,15-16,23,25,31H,11-14,17-19H2,1H3