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

Systemtic Name: N-(2-methoxyphenyl)-2-[5-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]ethanamide Openeye Name: 2-[4-allyl-5-[2-(3-methylanilino)-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]-N-(2-methoxyphenyl)acetamide CAS Name: N-(2-methoxyphenyl)-2-[5-[[2-(3-methylanilino)-2-oxoethyl]thio]-4-prop-2-enyl-1,2,4-triazol-3-yl]acetamide IUPAC Name: N-(2-methoxyphenyl)-2-[5-[2-(3-methylanilino)-2-oxoethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]acetamide Traditional Name: 2-[4-allyl-5-[[2-keto-2-(m-toluidino)ethyl]thio]-1,2,4-triazol-3-yl]-N-(2-methoxyphenyl)acetamide Formula: C23H25N5O3S MolecularWeight: 451.5413

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CSC2=NN=C(N2CC=C)CC(=O)NC3=CC=CC=C3OC

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CSC2=NN=C(N2CC=C)CC(=O)NC3=CC=CC=C3OC

InChI

InChI=1S/C23H25N5O3S/c1-4-12-28-20(14-21(29)25-18-10-5-6-11-19(18)31-3)26-27-23(28)32-15-22(30)24-17-9-7-8-16(2)13-17/h4-11,13H,1,12,14-15H2,2-3H3,(H,24,30)(H,25,29)