N-[[4-(5-chloranyl-2-methyl-phenyl)-5-[(3-methoxyphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]methyl]-2-ethyl-butanamide

Systemtic Name: N-[[4-(5-chloranyl-2-methyl-phenyl)-5-[(3-methoxyphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]methyl]-2-ethyl-butanamide Openeye Name: N-[[4-(5-chloro-2-methyl-phenyl)-5-[(3-methoxyphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]methyl]-2-ethyl-butanamide CAS Name: N-[[4-(5-chloro-2-methylphenyl)-5-[(3-methoxyphenyl)methylthio]-1,2,4-triazol-3-yl]methyl]-2-ethylbutanamide IUPAC Name: N-[[4-(5-chloro-2-methylphenyl)-5-[(3-methoxyphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]methyl]-2-ethylbutanamide Traditional Name: N-[[4-(5-chloro-2-methyl-phenyl)-5-(m-anisylthio)-1,2,4-triazol-3-yl]methyl]-2-ethyl-butyramide Formula: C24H29ClN4O2S MolecularWeight: 473.03066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)NCC1=NN=C(N1C2=C(C=CC(=C2)Cl)C)SCC3=CC(=CC=C3)OC

Isomeric SMILES

CCC(CC)C(=O)NCC1=NN=C(N1C2=C(C=CC(=C2)Cl)C)SCC3=CC(=CC=C3)OC

InChI

InChI=1S/C24H29ClN4O2S/c1-5-18(6-2)23(30)26-14-22-27-28-24(29(22)21-13-19(25)11-10-16(21)3)32-15-17-8-7-9-20(12-17)31-4/h7-13,18H,5-6,14-15H2,1-4H3,(H,26,30)