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

Systemtic Name: N-[2,3-bis(chloranyl)phenyl]-2-[5-[2-[(2,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]ethanamide Openeye Name: 2-[4-allyl-5-[2-(2,4-dimethylanilino)-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]-N-(2,3-dichlorophenyl)acetamide CAS Name: N-(2,3-dichlorophenyl)-2-[5-[[2-(2,4-dimethylanilino)-2-oxoethyl]thio]-4-prop-2-enyl-1,2,4-triazol-3-yl]acetamide IUPAC Name: N-(2,3-dichlorophenyl)-2-[5-[2-(2,4-dimethylanilino)-2-oxoethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]acetamide Traditional Name: 2-[4-allyl-5-[[2-(2,4-dimethylanilino)-2-keto-ethyl]thio]-1,2,4-triazol-3-yl]-N-(2,3-dichlorophenyl)acetamide Formula: C23H23Cl2N5O2S MolecularWeight: 504.43202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CSC2=NN=C(N2CC=C)CC(=O)NC3=C(C(=CC=C3)Cl)Cl)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CSC2=NN=C(N2CC=C)CC(=O)NC3=C(C(=CC=C3)Cl)Cl)C

InChI

InChI=1S/C23H23Cl2N5O2S/c1-4-10-30-19(12-20(31)27-18-7-5-6-16(24)22(18)25)28-29-23(30)33-13-21(32)26-17-9-8-14(2)11-15(17)3/h4-9,11H,1,10,12-13H2,2-3H3,(H,26,32)(H,27,31)