5-methyl-2-[2-(2-methylphenyl)ethanoylamino]-4-phenyl-N-(pyridin-3-ylmethyl)thiophene-3-carboxamide

Systemtic Name: 5-methyl-2-[2-(2-methylphenyl)ethanoylamino]-4-phenyl-N-(pyridin-3-ylmethyl)thiophene-3-carboxamide Openeye Name: 5-methyl-2-[[2-(o-tolyl)acetyl]amino]-4-phenyl-N-(3-pyridylmethyl)thiophene-3-carboxamide CAS Name: 5-methyl-2-[[2-(2-methylphenyl)-1-oxoethyl]amino]-4-phenyl-N-(3-pyridinylmethyl)-3-thiophenecarboxamide IUPAC Name: 5-methyl-2-[[2-(2-methylphenyl)acetyl]amino]-4-phenyl-N-(pyridin-3-ylmethyl)thiophene-3-carboxamide Traditional Name: 5-methyl-2-[[2-(o-tolyl)acetyl]amino]-4-phenyl-N-(3-pyridylmethyl)thiophene-3-carboxamide Formula: C27H25N3O2S MolecularWeight: 455.5713

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC(=O)NC2=C(C(=C(S2)C)C3=CC=CC=C3)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

CC1=CC=CC=C1CC(=O)NC2=C(C(=C(S2)C)C3=CC=CC=C3)C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C27H25N3O2S/c1-18-9-6-7-13-22(18)15-23(31)30-27-25(26(32)29-17-20-10-8-14-28-16-20)24(19(2)33-27)21-11-4-3-5-12-21/h3-14,16H,15,17H2,1-2H3,(H,29,32)(H,30,31)