N-(3,4-dichlorophenyl)-2-[4-methyl-5-[2-[[(1S,2S)-2-methylcyclohexyl]amino]-2-oxidanylidene-ethyl]sulfanyl-1,2,4-triazol-3-yl]ethanamide

Systemtic Name: N-(3,4-dichlorophenyl)-2-[4-methyl-5-[2-[[(1S,2S)-2-methylcyclohexyl]amino]-2-oxidanylidene-ethyl]sulfanyl-1,2,4-triazol-3-yl]ethanamide Openeye Name: N-(3,4-dichlorophenyl)-2-[4-methyl-5-[2-[[(1S,2S)-2-methylcyclohexyl]amino]-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]acetamide CAS Name: N-(3,4-dichlorophenyl)-2-[4-methyl-5-[[2-[[(1S,2S)-2-methylcyclohexyl]amino]-2-oxoethyl]thio]-1,2,4-triazol-3-yl]acetamide IUPAC Name: N-(3,4-dichlorophenyl)-2-[4-methyl-5-[2-[[(1S,2S)-2-methylcyclohexyl]amino]-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]acetamide Traditional Name: N-(3,4-dichlorophenyl)-2-[5-[[2-keto-2-[[(1S,2S)-2-methylcyclohexyl]amino]ethyl]thio]-4-methyl-1,2,4-triazol-3-yl]acetamide Formula: C20H25Cl2N5O2S MolecularWeight: 470.4158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)CSC2=NN=C(N2C)CC(=O)NC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=O)CSC2=NN=C(N2C)CC(=O)NC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C20H25Cl2N5O2S/c1-12-5-3-4-6-16(12)24-19(29)11-30-20-26-25-17(27(20)2)10-18(28)23-13-7-8-14(21)15(22)9-13/h7-9,12,16H,3-6,10-11H2,1-2H3,(H,23,28)(H,24,29)/t12-,16-/m0/s1