5-[2-(4-chlorophenyl)ethanoylamino]-4-cyano-3-methyl-N-(2-methylphenyl)thiophene-2-carboxamide

Systemtic Name: 5-[2-(4-chlorophenyl)ethanoylamino]-4-cyano-3-methyl-N-(2-methylphenyl)thiophene-2-carboxamide Openeye Name: 5-[[2-(4-chlorophenyl)acetyl]amino]-4-cyano-3-methyl-N-(o-tolyl)thiophene-2-carboxamide CAS Name: 5-[[2-(4-chlorophenyl)-1-oxoethyl]amino]-4-cyano-3-methyl-N-(2-methylphenyl)-2-thiophenecarboxamide IUPAC Name: 5-[[2-(4-chlorophenyl)acetyl]amino]-4-cyano-3-methyl-N-(2-methylphenyl)thiophene-2-carboxamide Traditional Name: 5-[[2-(4-chlorophenyl)acetyl]amino]-4-cyano-3-methyl-N-(o-tolyl)thiophene-2-carboxamide Formula: C22H18ClN3O2S MolecularWeight: 423.91522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C2=C(C(=C(S2)NC(=O)CC3=CC=C(C=C3)Cl)C#N)C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C2=C(C(=C(S2)NC(=O)CC3=CC=C(C=C3)Cl)C#N)C

InChI

InChI=1S/C22H18ClN3O2S/c1-13-5-3-4-6-18(13)25-21(28)20-14(2)17(12-24)22(29-20)26-19(27)11-15-7-9-16(23)10-8-15/h3-10H,11H2,1-2H3,(H,25,28)(H,26,27)