3-[2-(1H-indol-3-yl)ethyl]-6,7-dimethoxy-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-[2-(1H-indol-3-yl)ethyl]-6,7-dimethoxy-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-[2-(1H-indol-3-yl)ethyl]-6,7-dimethoxy-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[2-(1H-indol-3-yl)ethyl]-6,7-dimethoxy-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-[2-(1H-indol-3-yl)ethyl]-6,7-dimethoxy-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-[2-(1H-indol-3-yl)ethyl]-6,7-dimethoxy-2-thioxo-1H-quinazolin-4-one Formula: C20H19N3O3S MolecularWeight: 381.44816

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)N(C(=S)N2)CCC3=CNC4=CC=CC=C43)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)N(C(=S)N2)CCC3=CNC4=CC=CC=C43)OC

InChI

InChI=1S/C20H19N3O3S/c1-25-17-9-14-16(10-18(17)26-2)22-20(27)23(19(14)24)8-7-12-11-21-15-6-4-3-5-13(12)15/h3-6,9-11,21H,7-8H2,1-2H3,(H,22,27)