O-[4-[(6-phenylpyrimidin-4-yl)amino]phenyl] N-ethylcarbamothioate

Systemtic Name: O-[4-[(6-phenylpyrimidin-4-yl)amino]phenyl] N-ethylcarbamothioate Openeye Name: O-[4-[(6-phenylpyrimidin-4-yl)amino]phenyl] N-ethylcarbamothioate CAS Name: N-ethylcarbamothioic acid O-[4-[(6-phenyl-4-pyrimidinyl)amino]phenyl] ester IUPAC Name: O-[4-[(6-phenylpyrimidin-4-yl)amino]phenyl] N-ethylcarbamothioate Traditional Name: N-ethylthiocarbamic acid O-[4-[(6-phenylpyrimidin-4-yl)amino]phenyl] ester Formula: C19H18N4OS MolecularWeight: 350.43742

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)OC1=CC=C(C=C1)NC2=NC=NC(=C2)C3=CC=CC=C3

Isomeric SMILES

CCNC(=S)OC1=CC=C(C=C1)NC2=NC=NC(=C2)C3=CC=CC=C3

InChI

InChI=1S/C19H18N4OS/c1-2-20-19(25)24-16-10-8-15(9-11-16)23-18-12-17(21-13-22-18)14-6-4-3-5-7-14/h3-13H,2H2,1H3,(H,20,25)(H,21,22,23)