N-[3-cyano-5-methyl-4-[4-(2-methylpropyl)phenyl]thiophen-2-yl]-2,4-diethoxy-benzamide

Systemtic Name: N-[3-cyano-5-methyl-4-[4-(2-methylpropyl)phenyl]thiophen-2-yl]-2,4-diethoxy-benzamide Openeye Name: N-[3-cyano-4-(4-isobutylphenyl)-5-methyl-2-thienyl]-2,4-diethoxy-benzamide CAS Name: N-[3-cyano-5-methyl-4-[4-(2-methylpropyl)phenyl]-2-thiophenyl]-2,4-diethoxybenzamide IUPAC Name: N-[3-cyano-5-methyl-4-[4-(2-methylpropyl)phenyl]thiophen-2-yl]-2,4-diethoxybenzamide Traditional Name: N-[3-cyano-4-(4-isobutylphenyl)-5-methyl-2-thienyl]-2,4-diethoxy-benzamide Formula: C27H30N2O3S MolecularWeight: 462.6037

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)C(=O)NC2=C(C(=C(S2)C)C3=CC=C(C=C3)CC(C)C)C#N)OCC

Isomeric SMILES

CCOC1=CC(=C(C=C1)C(=O)NC2=C(C(=C(S2)C)C3=CC=C(C=C3)CC(C)C)C#N)OCC

InChI

InChI=1S/C27H30N2O3S/c1-6-31-21-12-13-22(24(15-21)32-7-2)26(30)29-27-23(16-28)25(18(5)33-27)20-10-8-19(9-11-20)14-17(3)4/h8-13,15,17H,6-7,14H2,1-5H3,(H,29,30)