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

Systemtic Name: N-[1-[5-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]-2-methyl-propyl]benzamide Openeye Name: N-[1-[4-allyl-5-[2-(4-methoxyphenyl)-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]-2-methyl-propyl]benzamide CAS Name: N-[1-[5-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]-4-prop-2-enyl-1,2,4-triazol-3-yl]-2-methylpropyl]benzamide IUPAC Name: N-[1-[5-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]-2-methylpropyl]benzamide Traditional Name: N-[1-[4-allyl-5-[[2-keto-2-(4-methoxyphenyl)ethyl]thio]-1,2,4-triazol-3-yl]-2-methyl-propyl]benzamide Formula: C25H28N4O3S MolecularWeight: 464.57982

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=NN=C(N1CC=C)SCC(=O)C2=CC=C(C=C2)OC)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)C(C1=NN=C(N1CC=C)SCC(=O)C2=CC=C(C=C2)OC)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H28N4O3S/c1-5-15-29-23(22(17(2)3)26-24(31)19-9-7-6-8-10-19)27-28-25(29)33-16-21(30)18-11-13-20(32-4)14-12-18/h5-14,17,22H,1,15-16H2,2-4H3,(H,26,31)