(E)-3-(3,4-dimethoxyphenyl)-N-[[5-[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]prop-2-enamide

Systemtic Name: (E)-3-(3,4-dimethoxyphenyl)-N-[[5-[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]prop-2-enamide Openeye Name: (E)-3-(3,4-dimethoxyphenyl)-N-[[5-[2-(2-ethylanilino)-2-oxo-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]prop-2-enamide CAS Name: (E)-3-(3,4-dimethoxyphenyl)-N-[[5-[[2-(2-ethylanilino)-2-oxoethyl]thio]-4-methyl-1,2,4-triazol-3-yl]methyl]-2-propenamide IUPAC Name: (E)-3-(3,4-dimethoxyphenyl)-N-[[5-[2-(2-ethylanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]prop-2-enamide Traditional Name: (E)-3-(3,4-dimethoxyphenyl)-N-[[5-[[2-(2-ethylanilino)-2-keto-ethyl]thio]-4-methyl-1,2,4-triazol-3-yl]methyl]acrylamide Formula: C25H29N5O4S MolecularWeight: 495.59386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CSC2=NN=C(N2C)CNC(=O)C=CC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CSC2=NN=C(N2C)CNC(=O)/C=C/C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C25H29N5O4S/c1-5-18-8-6-7-9-19(18)27-24(32)16-35-25-29-28-22(30(25)2)15-26-23(31)13-11-17-10-12-20(33-3)21(14-17)34-4/h6-14H,5,15-16H2,1-4H3,(H,26,31)(H,27,32)/b13-11+