methyl 2-[4-[(6-methylpyridin-2-yl)carbamothioylamino]phenyl]ethanoate

Systemtic Name: methyl 2-[4-[(6-methylpyridin-2-yl)carbamothioylamino]phenyl]ethanoate Openeye Name: methyl 2-[4-[(6-methyl-2-pyridyl)carbamothioylamino]phenyl]acetate CAS Name: 2-[4-[[[(6-methyl-2-pyridinyl)amino]-sulfanylidenemethyl]amino]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-[(6-methylpyridin-2-yl)carbamothioylamino]phenyl]acetate Traditional Name: 2-[4-[(6-methyl-2-pyridyl)thiocarbamoylamino]phenyl]acetic acid methyl ester Formula: C16H17N3O2S MolecularWeight: 315.39008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)NC(=S)NC2=CC=C(C=C2)CC(=O)OC

Isomeric SMILES

CC1=NC(=CC=C1)NC(=S)NC2=CC=C(C=C2)CC(=O)OC

InChI

InChI=1S/C16H17N3O2S/c1-11-4-3-5-14(17-11)19-16(22)18-13-8-6-12(7-9-13)10-15(20)21-2/h3-9H,10H2,1-2H3,(H2,17,18,19,22)