S-[[6-(2-methoxynaphthalen-1-yl)-4-phenyl-4,5-dihydropyrimidin-2-yl]] N-phenylcarbamothioate

Systemtic Name: S-[[6-(2-methoxynaphthalen-1-yl)-4-phenyl-4,5-dihydropyrimidin-2-yl]] N-phenylcarbamothioate Openeye Name: S-[[6-(2-methoxy-1-naphthyl)-4-phenyl-4,5-dihydropyrimidin-2-yl]] N-phenylcarbamothioate CAS Name: N-phenylcarbamothioic acid S-[[6-(2-methoxy-1-naphthalenyl)-4-phenyl-4,5-dihydropyrimidin-2-yl]] ester IUPAC Name: S-[[6-(2-methoxynaphthalen-1-yl)-4-phenyl-4,5-dihydropyrimidin-2-yl]] N-phenylcarbamothioate Traditional Name: N-phenylthiocarbamic acid S-[[6-(2-methoxy-1-naphthyl)-4-phenyl-4,5-dihydropyrimidin-2-yl]] ester Formula: C28H23N3O2S MolecularWeight: 465.56612

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=CC=CC=C2C=C1)C3=NC(=NC(C3)C4=CC=CC=C4)SC(=O)NC5=CC=CC=C5

Isomeric SMILES

COC1=C(C2=CC=CC=C2C=C1)C3=NC(=NC(C3)C4=CC=CC=C4)SC(=O)NC5=CC=CC=C5

InChI

InChI=1S/C28H23N3O2S/c1-33-25-17-16-19-10-8-9-15-22(19)26(25)24-18-23(20-11-4-2-5-12-20)30-27(31-24)34-28(32)29-21-13-6-3-7-14-21/h2-17,23H,18H2,1H3,(H,29,32)