S-[1-[4-[(6,7-dimethoxy-3-methyl-4-oxidanylidene-quinazolin-2-yl)methoxy]phenyl]-3-oxidanylidene-propan-2-yl] carbamothioate

Systemtic Name: S-[1-[4-[(6,7-dimethoxy-3-methyl-4-oxidanylidene-quinazolin-2-yl)methoxy]phenyl]-3-oxidanylidene-propan-2-yl] carbamothioate Openeye Name: S-[1-[[4-[(6,7-dimethoxy-3-methyl-4-oxo-quinazolin-2-yl)methoxy]phenyl]methyl]-2-oxo-ethyl] carbamothioate CAS Name: carbamothioic acid S-[1-[4-[(6,7-dimethoxy-3-methyl-4-oxo-2-quinazolinyl)methoxy]phenyl]-3-oxopropan-2-yl] ester IUPAC Name: S-[1-[4-[(6,7-dimethoxy-3-methyl-4-oxoquinazolin-2-yl)methoxy]phenyl]-3-oxopropan-2-yl] carbamothioate Traditional Name: thiocarbamic acid S-[1-formyl-2-[4-[(4-keto-6,7-dimethoxy-3-methyl-quinazolin-2-yl)methoxy]phenyl]ethyl] ester Formula: C22H23N3O6S MolecularWeight: 457.49952

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC2=CC(=C(C=C2C1=O)OC)OC)COC3=CC=C(C=C3)CC(C=O)SC(=O)N

Isomeric SMILES

CN1C(=NC2=CC(=C(C=C2C1=O)OC)OC)COC3=CC=C(C=C3)CC(C=O)SC(=O)N

InChI

InChI=1S/C22H23N3O6S/c1-25-20(24-17-10-19(30-3)18(29-2)9-16(17)21(25)27)12-31-14-6-4-13(5-7-14)8-15(11-26)32-22(23)28/h4-7,9-11,15H,8,12H2,1-3H3,(H2,23,28)