methyl 2-[2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl-methyl-amino]benzoate

Systemtic Name: methyl 2-[2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl-methyl-amino]benzoate Openeye Name: methyl 2-[[2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-methyl-amino]benzoate CAS Name: 2-[[2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]-methylamino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-methylamino]benzoate Traditional Name: 2-[[2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]acetyl]-methyl-amino]benzoic acid methyl ester Formula: C19H22N4O3S MolecularWeight: 386.46798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)OC)C(=O)CSC2=NN=C(N2C3CC3)C4CC4

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)OC)C(=O)CSC2=NN=C(N2C3CC3)C4CC4

InChI

InChI=1S/C19H22N4O3S/c1-22(15-6-4-3-5-14(15)18(25)26-2)16(24)11-27-19-21-20-17(12-7-8-12)23(19)13-9-10-13/h3-6,12-13H,7-11H2,1-2H3