(E)-2-(4-cyclopropyl-1,3-thiazol-2-yl)-3-(3,4-dimethoxyphenyl)prop-2-enenitrile

Systemtic Name: (E)-2-(4-cyclopropyl-1,3-thiazol-2-yl)-3-(3,4-dimethoxyphenyl)prop-2-enenitrile Openeye Name: (E)-2-(4-cyclopropylthiazol-2-yl)-3-(3,4-dimethoxyphenyl)prop-2-enenitrile CAS Name: (E)-2-(4-cyclopropyl-2-thiazolyl)-3-(3,4-dimethoxyphenyl)-2-propenenitrile IUPAC Name: (E)-2-(4-cyclopropyl-1,3-thiazol-2-yl)-3-(3,4-dimethoxyphenyl)prop-2-enenitrile Traditional Name: (E)-2-(4-cyclopropylthiazol-2-yl)-3-(3,4-dimethoxyphenyl)acrylonitrile Formula: C17H16N2O2S MolecularWeight: 312.38614

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=C(C#N)C2=NC(=CS2)C3CC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C(\C#N)/C2=NC(=CS2)C3CC3)OC

InChI

InChI=1S/C17H16N2O2S/c1-20-15-6-3-11(8-16(15)21-2)7-13(9-18)17-19-14(10-22-17)12-4-5-12/h3,6-8,10,12H,4-5H2,1-2H3/b13-7+