(E)-3-(4-butoxy-3-methoxy-phenyl)-2-(4-thiophen-2-yl-1,3-thiazol-2-yl)prop-2-enenitrile

Systemtic Name: (E)-3-(4-butoxy-3-methoxy-phenyl)-2-(4-thiophen-2-yl-1,3-thiazol-2-yl)prop-2-enenitrile Openeye Name: (E)-3-(4-butoxy-3-methoxy-phenyl)-2-[4-(2-thienyl)thiazol-2-yl]prop-2-enenitrile CAS Name: (E)-3-(4-butoxy-3-methoxyphenyl)-2-(4-thiophen-2-yl-2-thiazolyl)-2-propenenitrile IUPAC Name: (E)-3-(4-butoxy-3-methoxyphenyl)-2-(4-thiophen-2-yl-1,3-thiazol-2-yl)prop-2-enenitrile Traditional Name: (E)-3-(4-butoxy-3-methoxy-phenyl)-2-[4-(2-thienyl)thiazol-2-yl]acrylonitrile Formula: C21H20N2O2S2 MolecularWeight: 396.5257

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C=C(C#N)C2=NC(=CS2)C3=CC=CS3)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)/C=C(\C#N)/C2=NC(=CS2)C3=CC=CS3)OC

InChI

InChI=1S/C21H20N2O2S2/c1-3-4-9-25-18-8-7-15(12-19(18)24-2)11-16(13-22)21-23-17(14-27-21)20-6-5-10-26-20/h5-8,10-12,14H,3-4,9H2,1-2H3/b16-11+