ethyl 2-[(diphenylmethyl)carbamothioyl-(pyridin-2-ylmethyl)amino]ethanoate

Systemtic Name: ethyl 2-[(diphenylmethyl)carbamothioyl-(pyridin-2-ylmethyl)amino]ethanoate Openeye Name: ethyl 2-[benzhydrylcarbamothioyl(2-pyridylmethyl)amino]acetate CAS Name: 2-[[[(diphenylmethyl)amino]-sulfanylidenemethyl]-(2-pyridinylmethyl)amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[benzhydrylcarbamothioyl(pyridin-2-ylmethyl)amino]acetate Traditional Name: 2-[benzhydrylthiocarbamoyl(2-pyridylmethyl)amino]acetic acid ethyl ester Formula: C24H25N3O2S MolecularWeight: 419.5392

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(CC1=CC=CC=N1)C(=S)NC(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CN(CC1=CC=CC=N1)C(=S)NC(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C24H25N3O2S/c1-2-29-22(28)18-27(17-21-15-9-10-16-25-21)24(30)26-23(19-11-5-3-6-12-19)20-13-7-4-8-14-20/h3-16,23H,2,17-18H2,1H3,(H,26,30)