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

Systemtic Name: (E)-2-cyano-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(4-methoxyphenyl)prop-2-enamide Openeye Name: (E)-2-cyano-N-(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-(4-methoxyphenyl)prop-2-enamide CAS Name: (E)-2-cyano-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(4-methoxyphenyl)-2-propenamide IUPAC Name: (E)-2-cyano-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(4-methoxyphenyl)prop-2-enamide Traditional Name: (E)-2-cyano-N-(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-(4-methoxyphenyl)acrylamide Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C#N)NC(=O)C(=CC3=CC=C(C=C3)OC)C#N

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C#N)NC(=O)/C(=C/C3=CC=C(C=C3)OC)/C#N

InChI

InChI=1S/C21H19N3O2S/c1-13-3-8-17-18(12-23)21(27-19(17)9-13)24-20(25)15(11-22)10-14-4-6-16(26-2)7-5-14/h4-7,10,13H,3,8-9H2,1-2H3,(H,24,25)/b15-10+