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

Systemtic Name: N-[1-[5-[2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]ethyl]-2-(4-methoxyphenyl)ethanamide Openeye Name: N-[1-[4-allyl-5-[2-(3,4-dimethylanilino)-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]ethyl]-2-(4-methoxyphenyl)acetamide CAS Name: N-[1-[5-[[2-(3,4-dimethylanilino)-2-oxoethyl]thio]-4-prop-2-enyl-1,2,4-triazol-3-yl]ethyl]-2-(4-methoxyphenyl)acetamide IUPAC Name: N-[1-[5-[2-(3,4-dimethylanilino)-2-oxoethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]ethyl]-2-(4-methoxyphenyl)acetamide Traditional Name: N-[1-[4-allyl-5-[[2-(3,4-dimethylanilino)-2-keto-ethyl]thio]-1,2,4-triazol-3-yl]ethyl]-2-(4-methoxyphenyl)acetamide Formula: C26H31N5O3S MolecularWeight: 493.62104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC2=NN=C(N2CC=C)C(C)NC(=O)CC3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC2=NN=C(N2CC=C)C(C)NC(=O)CC3=CC=C(C=C3)OC)C

InChI

InChI=1S/C26H31N5O3S/c1-6-13-31-25(19(4)27-23(32)15-20-8-11-22(34-5)12-9-20)29-30-26(31)35-16-24(33)28-21-10-7-17(2)18(3)14-21/h6-12,14,19H,1,13,15-16H2,2-5H3,(H,27,32)(H,28,33)