[4-(2-methoxyphenyl)-2-sulfanylidene-3,4,5,6-tetrahydro-1H-benzo[h]quinazolin-8-yl] 2-phenylbenzoate

Systemtic Name: [4-(2-methoxyphenyl)-2-sulfanylidene-3,4,5,6-tetrahydro-1H-benzo[h]quinazolin-8-yl] 2-phenylbenzoate Openeye Name: [4-(2-methoxyphenyl)-2-thioxo-3,4,5,6-tetrahydro-1H-benzo[h]quinazolin-8-yl] 2-phenylbenzoate CAS Name: 2-phenylbenzoic acid [4-(2-methoxyphenyl)-2-sulfanylidene-3,4,5,6-tetrahydro-1H-benzo[h]quinazolin-8-yl] ester IUPAC Name: [4-(2-methoxyphenyl)-2-sulfanylidene-3,4,5,6-tetrahydro-1H-benzo[h]quinazolin-8-yl] 2-phenylbenzoate Traditional Name: 2-phenylbenzoic acid [4-(2-methoxyphenyl)-2-thioxo-3,4,5,6-tetrahydro-1H-benzo[h]quinazolin-8-yl] ester Formula: C32H26N2O3S MolecularWeight: 518.62544

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2C3=C(C4=C(CC3)C=C(C=C4)OC(=O)C5=CC=CC=C5C6=CC=CC=C6)NC(=S)N2

Isomeric SMILES

COC1=CC=CC=C1C2C3=C(C4=C(CC3)C=C(C=C4)OC(=O)C5=CC=CC=C5C6=CC=CC=C6)NC(=S)N2

InChI

InChI=1S/C32H26N2O3S/c1-36-28-14-8-7-13-26(28)30-27-17-15-21-19-22(16-18-24(21)29(27)33-32(38)34-30)37-31(35)25-12-6-5-11-23(25)20-9-3-2-4-10-20/h2-14,16,18-19,30H,15,17H2,1H3,(H2,33,34,38)