N-[3-cyano-5-methyl-4-[4-(2-methylpropyl)phenyl]thiophen-2-yl]-3-phenyl-prop-2-ynamide

Systemtic Name: N-[3-cyano-5-methyl-4-[4-(2-methylpropyl)phenyl]thiophen-2-yl]-3-phenyl-prop-2-ynamide Openeye Name: N-[3-cyano-4-(4-isobutylphenyl)-5-methyl-2-thienyl]-3-phenyl-prop-2-ynamide CAS Name: N-[3-cyano-5-methyl-4-[4-(2-methylpropyl)phenyl]-2-thiophenyl]-3-phenyl-2-propynamide IUPAC Name: N-[3-cyano-5-methyl-4-[4-(2-methylpropyl)phenyl]thiophen-2-yl]-3-phenylprop-2-ynamide Traditional Name: N-[3-cyano-4-(4-isobutylphenyl)-5-methyl-2-thienyl]-3-phenyl-propiolamide Formula: C25H22N2OS MolecularWeight: 398.51998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)C#CC2=CC=CC=C2)C#N)C3=CC=C(C=C3)CC(C)C

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)C#CC2=CC=CC=C2)C#N)C3=CC=C(C=C3)CC(C)C

InChI

InChI=1S/C25H22N2OS/c1-17(2)15-20-9-12-21(13-10-20)24-18(3)29-25(22(24)16-26)27-23(28)14-11-19-7-5-4-6-8-19/h4-10,12-13,17H,15H2,1-3H3,(H,27,28)