N-[5-[(4-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-cyano-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enamide

Systemtic Name: N-[5-[(4-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-cyano-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enamide Openeye Name: N-[5-[(4-chlorophenyl)methyl]thiazol-2-yl]-2-cyano-3-(4-hydroxy-3-methoxy-phenyl)prop-2-enamide CAS Name: N-[5-[(4-chlorophenyl)methyl]-2-thiazolyl]-2-cyano-3-(4-hydroxy-3-methoxyphenyl)-2-propenamide IUPAC Name: N-[5-[(4-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-cyano-3-(4-hydroxy-3-methoxyphenyl)prop-2-enamide Traditional Name: N-[5-(4-chlorobenzyl)thiazol-2-yl]-2-cyano-3-(4-hydroxy-3-methoxy-phenyl)acrylamide Formula: C21H16ClN3O3S MolecularWeight: 425.88804

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=NC=C(S2)CC3=CC=C(C=C3)Cl)O

Isomeric SMILES

COC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=NC=C(S2)CC3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C21H16ClN3O3S/c1-28-19-10-14(4-7-18(19)26)8-15(11-23)20(27)25-21-24-12-17(29-21)9-13-2-5-16(22)6-3-13/h2-8,10,12,26H,9H2,1H3,(H,24,25,27)