7-[[4-[2-(dimethylamino)-2-oxidanylidene-ethoxy]phenyl]carbamoyl]-3-methyl-2-sulfanylidene-quinazolin-4-olate

Systemtic Name: 7-[[4-[2-(dimethylamino)-2-oxidanylidene-ethoxy]phenyl]carbamoyl]-3-methyl-2-sulfanylidene-quinazolin-4-olate Openeye Name: 7-[[4-[2-(dimethylamino)-2-oxo-ethoxy]phenyl]carbamoyl]-3-methyl-2-thioxo-quinazolin-4-olate CAS Name: 7-[[4-[2-(dimethylamino)-2-oxoethoxy]anilino]-oxomethyl]-3-methyl-2-sulfanylidene-4-quinazolinolate IUPAC Name: 7-[[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]carbamoyl]-3-methyl-2-sulfanylidenequinazolin-4-olate Traditional Name: 7-[[4-[2-(dimethylamino)-2-keto-ethoxy]phenyl]carbamoyl]-3-methyl-2-thioxo-quinazolin-4-olate Formula: C20H19N4O4S- MolecularWeight: 411.45426

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C2C=CC(=CC2=NC1=S)C(=O)NC3=CC=C(C=C3)OCC(=O)N(C)C)[O-]

Isomeric SMILES

CN1C(=C2C=CC(=CC2=NC1=S)C(=O)NC3=CC=C(C=C3)OCC(=O)N(C)C)[O-]

InChI

InChI=1S/C20H20N4O4S/c1-23(2)17(25)11-28-14-7-5-13(6-8-14)21-18(26)12-4-9-15-16(10-12)22-20(29)24(3)19(15)27/h4-10,27H,11H2,1-3H3,(H,21,26)/p-1