3-[2-(4-chlorophenyl)sulfanylethyl]-6,7-dimethoxy-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-[2-(4-chlorophenyl)sulfanylethyl]-6,7-dimethoxy-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-[2-(4-chlorophenyl)sulfanylethyl]-6,7-dimethoxy-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[2-[(4-chlorophenyl)thio]ethyl]-6,7-dimethoxy-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-[2-(4-chlorophenyl)sulfanylethyl]-6,7-dimethoxy-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-[2-[(4-chlorophenyl)thio]ethyl]-6,7-dimethoxy-2-thioxo-1H-quinazolin-4-one Formula: C18H17ClN2O3S2 MolecularWeight: 408.92218

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)N(C(=S)N2)CCSC3=CC=C(C=C3)Cl)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)N(C(=S)N2)CCSC3=CC=C(C=C3)Cl)OC

InChI

InChI=1S/C18H17ClN2O3S2/c1-23-15-9-13-14(10-16(15)24-2)20-18(25)21(17(13)22)7-8-26-12-5-3-11(19)4-6-12/h3-6,9-10H,7-8H2,1-2H3,(H,20,25)