N-[1-[5-[2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]-2-methyl-propyl]-4-methoxy-benzamide

Systemtic Name: N-[1-[5-[2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]-2-methyl-propyl]-4-methoxy-benzamide Openeye Name: N-[1-[4-allyl-5-[2-(2-ethyl-6-methyl-anilino)-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]-2-methyl-propyl]-4-methoxy-benzamide CAS Name: N-[1-[5-[[2-(2-ethyl-6-methylanilino)-2-oxoethyl]thio]-4-prop-2-enyl-1,2,4-triazol-3-yl]-2-methylpropyl]-4-methoxybenzamide IUPAC Name: N-[1-[5-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]-2-methylpropyl]-4-methoxybenzamide Traditional Name: N-[1-[4-allyl-5-[[2-(2-ethyl-6-methyl-anilino)-2-keto-ethyl]thio]-1,2,4-triazol-3-yl]-2-methyl-propyl]-4-methoxy-benzamide Formula: C28H35N5O3S MolecularWeight: 521.6742

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)CSC2=NN=C(N2CC=C)C(C(C)C)NC(=O)C3=CC=C(C=C3)OC)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)CSC2=NN=C(N2CC=C)C(C(C)C)NC(=O)C3=CC=C(C=C3)OC)C

InChI

InChI=1S/C28H35N5O3S/c1-7-16-33-26(24(18(3)4)30-27(35)21-12-14-22(36-6)15-13-21)31-32-28(33)37-17-23(34)29-25-19(5)10-9-11-20(25)8-2/h7,9-15,18,24H,1,8,16-17H2,2-6H3,(H,29,34)(H,30,35)