(E)-2-cyano-3-(4-hexoxy-3-methoxy-phenyl)-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(4-hexoxy-3-methoxy-phenyl)-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)prop-2-enamide Openeye Name: (E)-2-cyano-N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]-3-(4-hexoxy-3-methoxy-phenyl)prop-2-enamide CAS Name: (E)-2-cyano-3-(4-hexoxy-3-methoxyphenyl)-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)-2-propenamide IUPAC Name: (E)-2-cyano-3-(4-hexoxy-3-methoxyphenyl)-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)prop-2-enamide Traditional Name: (E)-2-cyano-N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]-3-(4-hexoxy-3-methoxy-phenyl)acrylamide Formula: C24H32N4O3S MolecularWeight: 456.60088

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C=C(C#N)C(=O)NC2=NN=C(S2)C(CC)CC)OC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)/C=C(\C#N)/C(=O)NC2=NN=C(S2)C(CC)CC)OC

InChI

InChI=1S/C24H32N4O3S/c1-5-8-9-10-13-31-20-12-11-17(15-21(20)30-4)14-19(16-25)22(29)26-24-28-27-23(32-24)18(6-2)7-3/h11-12,14-15,18H,5-10,13H2,1-4H3,(H,26,28,29)/b19-14+