3-(2,5-dimethoxyphenyl)-N,N-diethyl-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: 3-(2,5-dimethoxyphenyl)-N,N-diethyl-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-(2,5-dimethoxyphenyl)-N,N-diethyl-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 3-(2,5-dimethoxyphenyl)-N,N-diethyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 3-(2,5-dimethoxyphenyl)-N,N-diethyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-(2,5-dimethoxyphenyl)-N,N-diethyl-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)C3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CCN(CC)C(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)C3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C21H23N3O4S/c1-5-23(6-2)19(25)13-7-9-15-16(11-13)22-21(29)24(20(15)26)17-12-14(27-3)8-10-18(17)28-4/h7-12H,5-6H2,1-4H3,(H,22,29)