2-(2-phenyl-4-sulfanylidene-5,6,7,8-tetrahydroquinazolin-1-yl)ethyl benzoate

Systemtic Name: 2-(2-phenyl-4-sulfanylidene-5,6,7,8-tetrahydroquinazolin-1-yl)ethyl benzoate Openeye Name: 2-(2-phenyl-4-thioxo-5,6,7,8-tetrahydroquinazolin-1-yl)ethyl benzoate CAS Name: benzoic acid 2-(2-phenyl-4-sulfanylidene-5,6,7,8-tetrahydroquinazolin-1-yl)ethyl ester IUPAC Name: 2-(2-phenyl-4-sulfanylidene-5,6,7,8-tetrahydroquinazolin-1-yl)ethyl benzoate Traditional Name: benzoic acid 2-(2-phenyl-4-thioxo-5,6,7,8-tetrahydroquinazolin-1-yl)ethyl ester Formula: C23H22N2O2S MolecularWeight: 390.49798

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=S)N=C(N2CCOC(=O)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CCC2=C(C1)C(=S)N=C(N2CCOC(=O)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H22N2O2S/c26-23(18-11-5-2-6-12-18)27-16-15-25-20-14-8-7-13-19(20)22(28)24-21(25)17-9-3-1-4-10-17/h1-6,9-12H,7-8,13-16H2