N-(2-azanylethyl)-4-[(3-methoxyphenyl)methyl-thiophen-2-ylcarbonyl-amino]-1-pyridin-3-ylcarbonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-4-[(3-methoxyphenyl)methyl-thiophen-2-ylcarbonyl-amino]-1-pyridin-3-ylcarbonyl-pyrrolidine-2-carboxamide Openeye Name: N-(2-aminoethyl)-4-[(3-methoxyphenyl)methyl-(thiophene-2-carbonyl)amino]-1-(pyridine-3-carbonyl)pyrrolidine-2-carboxamide CAS Name: N-(2-aminoethyl)-4-[(3-methoxyphenyl)methyl-[oxo(thiophen-2-yl)methyl]amino]-1-[oxo(3-pyridinyl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(2-aminoethyl)-4-[(3-methoxyphenyl)methyl-(thiophene-2-carbonyl)amino]-1-(pyridine-3-carbonyl)pyrrolidine-2-carboxamide Traditional Name: N-(2-aminoethyl)-4-[m-anisyl(2-thenoyl)amino]-1-nicotinoyl-pyrrolidine-2-carboxamide Formula: C26H29N5O4S MolecularWeight: 507.60456

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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)NCCN)C(=O)C4=CC=CS4

Isomeric SMILES

COC1=CC=CC(=C1)CN(C2CC(N(C2)C(=O)C3=CN=CC=C3)C(=O)NCCN)C(=O)C4=CC=CS4

InChI

InChI=1S/C26H29N5O4S/c1-35-21-7-2-5-18(13-21)16-30(26(34)23-8-4-12-36-23)20-14-22(24(32)29-11-9-27)31(17-20)25(33)19-6-3-10-28-15-19/h2-8,10,12-13,15,20,22H,9,11,14,16-17,27H2,1H3,(H,29,32)