N-[5-[(E)-2-(4-butoxy-3-methoxy-phenyl)-1-cyano-ethenyl]-1,3,4-thiadiazol-2-yl]ethanamide

Systemtic Name: N-[5-[(E)-2-(4-butoxy-3-methoxy-phenyl)-1-cyano-ethenyl]-1,3,4-thiadiazol-2-yl]ethanamide Openeye Name: N-[5-[(E)-2-(4-butoxy-3-methoxy-phenyl)-1-cyano-vinyl]-1,3,4-thiadiazol-2-yl]acetamide CAS Name: N-[5-[(E)-2-(4-butoxy-3-methoxyphenyl)-1-cyanoethenyl]-1,3,4-thiadiazol-2-yl]acetamide IUPAC Name: N-[5-[(E)-2-(4-butoxy-3-methoxyphenyl)-1-cyanoethenyl]-1,3,4-thiadiazol-2-yl]acetamide Traditional Name: N-[5-[(E)-2-(4-butoxy-3-methoxy-phenyl)-1-cyano-vinyl]-1,3,4-thiadiazol-2-yl]acetamide Formula: C18H20N4O3S MolecularWeight: 372.4414

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C=C(C#N)C2=NN=C(S2)NC(=O)C)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)/C=C(\C#N)/C2=NN=C(S2)NC(=O)C)OC

InChI

InChI=1S/C18H20N4O3S/c1-4-5-8-25-15-7-6-13(10-16(15)24-3)9-14(11-19)17-21-22-18(26-17)20-12(2)23/h6-7,9-10H,4-5,8H2,1-3H3,(H,20,22,23)/b14-9+