(4S)-5-(benzotriazol-1-yl)-4-(4-methoxyphenyl)-6-phenyl-3,4-dihydro-1H-pyrimidine-2-thione

Systemtic Name: (4S)-5-(benzotriazol-1-yl)-4-(4-methoxyphenyl)-6-phenyl-3,4-dihydro-1H-pyrimidine-2-thione Openeye Name: (4S)-5-(benzotriazol-1-yl)-4-(4-methoxyphenyl)-6-phenyl-3,4-dihydro-1H-pyrimidine-2-thione CAS Name: (4S)-5-(1-benzotriazolyl)-4-(4-methoxyphenyl)-6-phenyl-3,4-dihydro-1H-pyrimidine-2-thione IUPAC Name: (4S)-5-(benzotriazol-1-yl)-4-(4-methoxyphenyl)-6-phenyl-3,4-dihydro-1H-pyrimidine-2-thione Traditional Name: (4S)-5-(benzotriazol-1-yl)-4-(4-methoxyphenyl)-6-phenyl-3,4-dihydro-1H-pyrimidine-2-thione Formula: C23H19N5OS MolecularWeight: 413.49486

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(=C(NC(=S)N2)C3=CC=CC=C3)N4C5=CC=CC=C5N=N4

Isomeric SMILES

COC1=CC=C(C=C1)[C@H]2C(=C(NC(=S)N2)C3=CC=CC=C3)N4C5=CC=CC=C5N=N4

InChI

InChI=1S/C23H19N5OS/c1-29-17-13-11-16(12-14-17)21-22(28-19-10-6-5-9-18(19)26-27-28)20(24-23(30)25-21)15-7-3-2-4-8-15/h2-14,21H,1H3,(H2,24,25,30)/t21-/m0/s1