3-(4-butoxyphenyl)-2-cyano-N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]prop-2-enamide

Systemtic Name: 3-(4-butoxyphenyl)-2-cyano-N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]prop-2-enamide Openeye Name: 3-(4-butoxyphenyl)-2-cyano-N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]prop-2-enamide CAS Name: 3-(4-butoxyphenyl)-2-cyano-N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]-2-propenamide IUPAC Name: 3-(4-butoxyphenyl)-2-cyano-N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]prop-2-enamide Traditional Name: 3-(4-butoxyphenyl)-2-cyano-N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]acrylamide Formula: C18H20N4O3S MolecularWeight: 372.4414

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=NN=C(S2)COC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=NN=C(S2)COC

InChI

InChI=1S/C18H20N4O3S/c1-3-4-9-25-15-7-5-13(6-8-15)10-14(11-19)17(23)20-18-22-21-16(26-18)12-24-2/h5-8,10H,3-4,9,12H2,1-2H3,(H,20,22,23)