ethyl 2-[1-[[(diphenylmethyl)-methyl-amino]methyl]-4-methyl-5-sulfanylidene-1,2,4-triazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[1-[[(diphenylmethyl)-methyl-amino]methyl]-4-methyl-5-sulfanylidene-1,2,4-triazol-3-yl]ethanoate Openeye Name: ethyl 2-[1-[[benzhydryl(methyl)amino]methyl]-4-methyl-5-thioxo-1,2,4-triazol-3-yl]acetate CAS Name: 2-[1-[[(diphenylmethyl)-methylamino]methyl]-4-methyl-5-sulfanylidene-1,2,4-triazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[1-[[benzhydryl(methyl)amino]methyl]-4-methyl-5-sulfanylidene-1,2,4-triazol-3-yl]acetate Traditional Name: 2-[1-[[benzhydryl(methyl)amino]methyl]-4-methyl-5-thioxo-1,2,4-triazol-3-yl]acetic acid ethyl ester Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=NN(C(=S)N1C)CN(C)C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CC1=NN(C(=S)N1C)CN(C)C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H26N4O2S/c1-4-28-20(27)15-19-23-26(22(29)25(19)3)16-24(2)21(17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5-14,21H,4,15-16H2,1-3H3