2-[2-[(E)-(4-dimethylaminophenyl)methylidenecarbamothioyl]hydrazinyl]-N-(2-methyl-4-oxidanylidene-quinazolin-3-yl)ethanamide

Systemtic Name: 2-[2-[(E)-(4-dimethylaminophenyl)methylidenecarbamothioyl]hydrazinyl]-N-(2-methyl-4-oxidanylidene-quinazolin-3-yl)ethanamide Openeye Name: 2-[2-[(E)-(4-dimethylaminophenyl)methylenecarbamothioyl]hydrazino]-N-(2-methyl-4-oxo-quinazolin-3-yl)acetamide CAS Name: 2-[[[(E)-(4-dimethylaminophenyl)methylideneamino]-sulfanylidenemethyl]hydrazo]-N-(2-methyl-4-oxo-3-quinazolinyl)acetamide IUPAC Name: 2-[2-[(E)-(4-dimethylaminophenyl)methylidenecarbamothioyl]hydrazinyl]-N-(2-methyl-4-oxoquinazolin-3-yl)acetamide Traditional Name: 2-[N'-[(E)-[4-(dimethylamino)benzylidene]thiocarbamoyl]hydrazino]-N-(4-keto-2-methyl-quinazolin-3-yl)acetamide Formula: C21H23N7O2S MolecularWeight: 437.51802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1NC(=O)CNNC(=S)N=CC3=CC=C(C=C3)N(C)C

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1NC(=O)CNNC(=S)/N=C/C3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C21H23N7O2S/c1-14-24-18-7-5-4-6-17(18)20(30)28(14)26-19(29)13-23-25-21(31)22-12-15-8-10-16(11-9-15)27(2)3/h4-12,23H,13H2,1-3H3,(H,25,31)(H,26,29)/b22-12+