N-(1,3-benzothiazol-2-yl)-2-cyano-3-(4-ethoxy-3-methoxy-phenyl)prop-2-enamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-cyano-3-(4-ethoxy-3-methoxy-phenyl)prop-2-enamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-cyano-3-(4-ethoxy-3-methoxy-phenyl)prop-2-enamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-cyano-3-(4-ethoxy-3-methoxyphenyl)-2-propenamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-cyano-3-(4-ethoxy-3-methoxyphenyl)prop-2-enamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-cyano-3-(4-ethoxy-3-methoxy-phenyl)acrylamide Formula: C20H17N3O3S MolecularWeight: 379.43228

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C=C(C#N)C(=O)NC2=NC3=CC=CC=C3S2)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C=C(C#N)C(=O)NC2=NC3=CC=CC=C3S2)OC

InChI

InChI=1S/C20H17N3O3S/c1-3-26-16-9-8-13(11-17(16)25-2)10-14(12-21)19(24)23-20-22-15-6-4-5-7-18(15)27-20/h4-11H,3H2,1-2H3,(H,22,23,24)