(E)-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(4-propoxyphenyl)prop-2-enamide

Systemtic Name: (E)-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(4-propoxyphenyl)prop-2-enamide Openeye Name: (E)-N-(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-(4-propoxyphenyl)prop-2-enamide CAS Name: (E)-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(4-propoxyphenyl)-2-propenamide IUPAC Name: (E)-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(4-propoxyphenyl)prop-2-enamide Traditional Name: (E)-N-(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-(4-propoxyphenyl)acrylamide Formula: C22H24N2O2S MolecularWeight: 380.50316

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C=CC(=O)NC2=C(C3=C(S2)CC(CC3)C)C#N

Isomeric SMILES

CCCOC1=CC=C(C=C1)/C=C/C(=O)NC2=C(C3=C(S2)CC(CC3)C)C#N

InChI

InChI=1S/C22H24N2O2S/c1-3-12-26-17-8-5-16(6-9-17)7-11-21(25)24-22-19(14-23)18-10-4-15(2)13-20(18)27-22/h5-9,11,15H,3-4,10,12-13H2,1-2H3,(H,24,25)/b11-7+