O-[3-[(6-methylpyrimidin-4-yl)amino]phenyl] N-phenylcarbamothioate

Systemtic Name: O-[3-[(6-methylpyrimidin-4-yl)amino]phenyl] N-phenylcarbamothioate Openeye Name: O-[3-[(6-methylpyrimidin-4-yl)amino]phenyl] N-phenylcarbamothioate CAS Name: N-phenylcarbamothioic acid O-[3-[(6-methyl-4-pyrimidinyl)amino]phenyl] ester IUPAC Name: O-[3-[(6-methylpyrimidin-4-yl)amino]phenyl] N-phenylcarbamothioate Traditional Name: N-phenylthiocarbamic acid O-[3-[(6-methylpyrimidin-4-yl)amino]phenyl] ester Formula: C18H16N4OS MolecularWeight: 336.41084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=N1)NC2=CC(=CC=C2)OC(=S)NC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=NC=N1)NC2=CC(=CC=C2)OC(=S)NC3=CC=CC=C3

InChI

InChI=1S/C18H16N4OS/c1-13-10-17(20-12-19-13)21-15-8-5-9-16(11-15)23-18(24)22-14-6-3-2-4-7-14/h2-12H,1H3,(H,22,24)(H,19,20,21)