N-[[5-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]-2-methyl-benzamide

Systemtic Name: N-[[5-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]-2-methyl-benzamide Openeye Name: N-[[4-allyl-5-[2-(4-methoxyphenyl)-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-2-methyl-benzamide CAS Name: N-[[5-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]-2-methylbenzamide IUPAC Name: N-[[5-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]-2-methylbenzamide Traditional Name: N-[[4-allyl-5-[[2-keto-2-(4-methoxyphenyl)ethyl]thio]-1,2,4-triazol-3-yl]methyl]-2-methyl-benzamide Formula: C23H24N4O3S MolecularWeight: 436.52666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NCC2=NN=C(N2CC=C)SCC(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=CC=C1C(=O)NCC2=NN=C(N2CC=C)SCC(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C23H24N4O3S/c1-4-13-27-21(14-24-22(29)19-8-6-5-7-16(19)2)25-26-23(27)31-15-20(28)17-9-11-18(30-3)12-10-17/h4-12H,1,13-15H2,2-3H3,(H,24,29)