N-[(2,4-dimethylphenyl)carbamoyl]-2-[3-(2-hydroxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[(2,4-dimethylphenyl)carbamoyl]-2-[3-(2-hydroxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-[(2,4-dimethylphenyl)carbamoyl]-2-[3-(2-hydroxyethyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-[(2,4-dimethylanilino)-oxomethyl]-2-[[3-(2-hydroxyethyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-[(2,4-dimethylphenyl)carbamoyl]-2-[3-(2-hydroxyethyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-[(2,4-dimethylphenyl)carbamoyl]-2-[[3-(2-hydroxyethyl)-4-keto-quinazolin-2-yl]thio]acetamide Formula: C21H22N4O4S MolecularWeight: 426.48878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCO)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCO)C

InChI

InChI=1S/C21H22N4O4S/c1-13-7-8-16(14(2)11-13)22-20(29)24-18(27)12-30-21-23-17-6-4-3-5-15(17)19(28)25(21)9-10-26/h3-8,11,26H,9-10,12H2,1-2H3,(H2,22,24,27,29)