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

Systemtic Name: N-[(3-methoxyphenyl)methyl]-N-(5-piperazin-1-ylcarbonyl-1-pyridin-3-ylcarbonyl-pyrrolidin-3-yl)thiophene-2-carboxamide Openeye Name: N-[(3-methoxyphenyl)methyl]-N-[5-(piperazine-1-carbonyl)-1-(pyridine-3-carbonyl)pyrrolidin-3-yl]thiophene-2-carboxamide CAS Name: N-[(3-methoxyphenyl)methyl]-N-[5-[oxo(1-piperazinyl)methyl]-1-[oxo(3-pyridinyl)methyl]-3-pyrrolidinyl]-2-thiophenecarboxamide IUPAC Name: N-[(3-methoxyphenyl)methyl]-N-[5-(piperazine-1-carbonyl)-1-(pyridine-3-carbonyl)pyrrolidin-3-yl]thiophene-2-carboxamide Traditional Name: N-m-anisyl-N-[1-nicotinoyl-5-(piperazine-1-carbonyl)pyrrolidin-3-yl]thiophene-2-carboxamide Formula: C28H31N5O4S MolecularWeight: 533.64184

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H31N5O4S/c1-37-23-7-2-5-20(15-23)18-32(28(36)25-8-4-14-38-25)22-16-24(27(35)31-12-10-29-11-13-31)33(19-22)26(34)21-6-3-9-30-17-21/h2-9,14-15,17,22,24,29H,10-13,16,18-19H2,1H3