2-cyano-N-(6-methyl-1,3-benzothiazol-2-yl)-3-(4-propoxyphenyl)prop-2-enamide

Systemtic Name: 2-cyano-N-(6-methyl-1,3-benzothiazol-2-yl)-3-(4-propoxyphenyl)prop-2-enamide Openeye Name: 2-cyano-N-(6-methyl-1,3-benzothiazol-2-yl)-3-(4-propoxyphenyl)prop-2-enamide CAS Name: 2-cyano-N-(6-methyl-1,3-benzothiazol-2-yl)-3-(4-propoxyphenyl)-2-propenamide IUPAC Name: 2-cyano-N-(6-methyl-1,3-benzothiazol-2-yl)-3-(4-propoxyphenyl)prop-2-enamide Traditional Name: 2-cyano-N-(6-methyl-1,3-benzothiazol-2-yl)-3-(4-propoxyphenyl)acrylamide Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=NC3=C(S2)C=C(C=C3)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=NC3=C(S2)C=C(C=C3)C

InChI

InChI=1S/C21H19N3O2S/c1-3-10-26-17-7-5-15(6-8-17)12-16(13-22)20(25)24-21-23-18-9-4-14(2)11-19(18)27-21/h4-9,11-12H,3,10H2,1-2H3,(H,23,24,25)