2-cyano-N-[4-(2,4-dichlorophenyl)-1,3-thiazol-2-yl]-3-(4-propoxyphenyl)prop-2-enamide

Systemtic Name: 2-cyano-N-[4-(2,4-dichlorophenyl)-1,3-thiazol-2-yl]-3-(4-propoxyphenyl)prop-2-enamide Openeye Name: 2-cyano-N-[4-(2,4-dichlorophenyl)thiazol-2-yl]-3-(4-propoxyphenyl)prop-2-enamide CAS Name: 2-cyano-N-[4-(2,4-dichlorophenyl)-2-thiazolyl]-3-(4-propoxyphenyl)-2-propenamide IUPAC Name: 2-cyano-N-[4-(2,4-dichlorophenyl)-1,3-thiazol-2-yl]-3-(4-propoxyphenyl)prop-2-enamide Traditional Name: 2-cyano-N-[4-(2,4-dichlorophenyl)thiazol-2-yl]-3-(4-propoxyphenyl)acrylamide Formula: C22H17Cl2N3O2S MolecularWeight: 458.36028

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=NC(=CS2)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=NC(=CS2)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C22H17Cl2N3O2S/c1-2-9-29-17-6-3-14(4-7-17)10-15(12-25)21(28)27-22-26-20(13-30-22)18-8-5-16(23)11-19(18)24/h3-8,10-11,13H,2,9H2,1H3,(H,26,27,28)