tert-butyl 4-oxidanylidene-2-phenyl-6-(phenylsulfonyl)-5,6,7,8-tetrahydroquinazoline-3-carboxylate

Systemtic Name: tert-butyl 4-oxidanylidene-2-phenyl-6-(phenylsulfonyl)-5,6,7,8-tetrahydroquinazoline-3-carboxylate Openeye Name: tert-butyl 6-(benzenesulfonyl)-4-oxo-2-phenyl-5,6,7,8-tetrahydroquinazoline-3-carboxylate CAS Name: 6-(benzenesulfonyl)-4-oxo-2-phenyl-5,6,7,8-tetrahydroquinazoline-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 6-(benzenesulfonyl)-4-oxo-2-phenyl-5,6,7,8-tetrahydroquinazoline-3-carboxylate Traditional Name: 6-besyl-4-keto-2-phenyl-5,6,7,8-tetrahydroquinazoline-3-carboxylic acid tert-butyl ester Formula: C25H26N2O5S MolecularWeight: 466.54934

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(=NC2=C(C1=O)CC(CC2)S(=O)(=O)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1C(=NC2=C(C1=O)CC(CC2)S(=O)(=O)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H26N2O5S/c1-25(2,3)32-24(29)27-22(17-10-6-4-7-11-17)26-21-15-14-19(16-20(21)23(27)28)33(30,31)18-12-8-5-9-13-18/h4-13,19H,14-16H2,1-3H3