3-[(4-chloranyl-2,5-dimethoxy-phenyl)amino]-2-(4-phenyl-1,3-thiazol-2-yl)prop-2-enenitrile

Systemtic Name: 3-[(4-chloranyl-2,5-dimethoxy-phenyl)amino]-2-(4-phenyl-1,3-thiazol-2-yl)prop-2-enenitrile Openeye Name: 3-(4-chloro-2,5-dimethoxy-anilino)-2-(4-phenylthiazol-2-yl)prop-2-enenitrile CAS Name: 3-(4-chloro-2,5-dimethoxyanilino)-2-(4-phenyl-2-thiazolyl)-2-propenenitrile IUPAC Name: 3-(4-chloro-2,5-dimethoxyanilino)-2-(4-phenyl-1,3-thiazol-2-yl)prop-2-enenitrile Traditional Name: 3-(4-chloro-2,5-dimethoxy-anilino)-2-(4-phenylthiazol-2-yl)acrylonitrile Formula: C20H16ClN3O2S MolecularWeight: 397.87794

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC=C(C#N)C2=NC(=CS2)C3=CC=CC=C3)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC=C(C#N)C2=NC(=CS2)C3=CC=CC=C3)OC)Cl

InChI

InChI=1S/C20H16ClN3O2S/c1-25-18-9-16(19(26-2)8-15(18)21)23-11-14(10-22)20-24-17(12-27-20)13-6-4-3-5-7-13/h3-9,11-12,23H,1-2H3