3-(3,4-dimethoxyphenyl)-5-[(4-propan-2-ylphenyl)methylsulfanyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-(3,4-dimethoxyphenyl)-5-[(4-propan-2-ylphenyl)methylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-(3,4-dimethoxyphenyl)-5-[(4-isopropylphenyl)methylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-(3,4-dimethoxyphenyl)-5-[(4-propan-2-ylphenyl)methylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-(3,4-dimethoxyphenyl)-5-[(4-propan-2-ylphenyl)methylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-(3,4-dimethoxyphenyl)-5-[(4-isopropylbenzyl)thio]-1,2,4-triazol-4-yl]amine Formula: C20H24N4O2S MolecularWeight: 384.49516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CSC2=NN=C(N2N)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CSC2=NN=C(N2N)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C20H24N4O2S/c1-13(2)15-7-5-14(6-8-15)12-27-20-23-22-19(24(20)21)16-9-10-17(25-3)18(11-16)26-4/h5-11,13H,12,21H2,1-4H3