N-[4-(diethylamino)-2-methyl-phenyl]-4-oxidanylidene-1H-quinazoline-2-carbothioamide

Systemtic Name: N-[4-(diethylamino)-2-methyl-phenyl]-4-oxidanylidene-1H-quinazoline-2-carbothioamide Openeye Name: N-[4-(diethylamino)-2-methyl-phenyl]-4-oxo-1H-quinazoline-2-carbothioamide CAS Name: N-[4-(diethylamino)-2-methylphenyl]-4-oxo-1H-quinazoline-2-carbothioamide IUPAC Name: N-[4-(diethylamino)-2-methylphenyl]-4-oxo-1H-quinazoline-2-carbothioamide Traditional Name: N-[4-(diethylamino)-2-methyl-phenyl]-4-keto-1H-quinazoline-2-carbothioamide Formula: C20H22N4OS MolecularWeight: 366.47988

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C=C1)NC(=S)C2=NC(=O)C3=CC=CC=C3N2)C

Isomeric SMILES

CCN(CC)C1=CC(=C(C=C1)NC(=S)C2=NC(=O)C3=CC=CC=C3N2)C

InChI

InChI=1S/C20H22N4OS/c1-4-24(5-2)14-10-11-16(13(3)12-14)22-20(26)18-21-17-9-7-6-8-15(17)19(25)23-18/h6-12H,4-5H2,1-3H3,(H,22,26)(H,21,23,25)