N-[(E)-(4-dimethylaminophenyl)methylideneamino]-2-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[(E)-(4-dimethylaminophenyl)methylideneamino]-2-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-[(E)-(4-dimethylaminophenyl)methyleneamino]-2-(3-ethyl-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-[(E)-(4-dimethylaminophenyl)methylideneamino]-2-[(3-ethyl-4-oxo-2-quinazolinyl)thio]acetamide IUPAC Name: N-[(E)-(4-dimethylaminophenyl)methylideneamino]-2-(3-ethyl-4-oxoquinazolin-2-yl)sulfanylacetamide Traditional Name: N-[(E)-[4-(dimethylamino)benzylidene]amino]-2-[(3-ethyl-4-keto-quinazolin-2-yl)thio]acetamide Formula: C21H23N5O2S MolecularWeight: 409.50462

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NN=CC3=CC=C(C=C3)N(C)C

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N/N=C/C3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C21H23N5O2S/c1-4-26-20(28)17-7-5-6-8-18(17)23-21(26)29-14-19(27)24-22-13-15-9-11-16(12-10-15)25(2)3/h5-13H,4,14H2,1-3H3,(H,24,27)/b22-13+