[4,5-diacetyloxy-6-(4-azanylidene-3-phenyl-2-sulfanylidene-quinazolin-1-yl)oxan-3-yl] ethanoate

Systemtic Name: [4,5-diacetyloxy-6-(4-azanylidene-3-phenyl-2-sulfanylidene-quinazolin-1-yl)oxan-3-yl] ethanoate Openeye Name: [4,5-diacetoxy-6-(4-imino-3-phenyl-2-thioxo-quinazolin-1-yl)tetrahydropyran-3-yl] acetate CAS Name: acetic acid [4,5-diacetyloxy-6-(4-imino-3-phenyl-2-sulfanylidene-1-quinazolinyl)-3-oxanyl] ester IUPAC Name: [4,5-diacetyloxy-6-(4-imino-3-phenyl-2-sulfanylidenequinazolin-1-yl)oxan-3-yl] acetate Traditional Name: acetic acid [4,5-diacetoxy-6-(4-imino-3-phenyl-2-thioxo-quinazolin-1-yl)tetrahydropyran-3-yl] ester Formula: C25H25N3O7S MolecularWeight: 511.5469

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1COC(C(C1OC(=O)C)OC(=O)C)N2C3=CC=CC=C3C(=N)N(C2=S)C4=CC=CC=C4

Isomeric SMILES

CC(=O)OC1COC(C(C1OC(=O)C)OC(=O)C)N2C3=CC=CC=C3C(=N)N(C2=S)C4=CC=CC=C4

InChI

InChI=1S/C25H25N3O7S/c1-14(29)33-20-13-32-24(22(35-16(3)31)21(20)34-15(2)30)28-19-12-8-7-11-18(19)23(26)27(25(28)36)17-9-5-4-6-10-17/h4-12,20-22,24,26H,13H2,1-3H3