N-butyl-3-(7-chloranyl-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)benzamide

Systemtic Name: N-butyl-3-(7-chloranyl-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)benzamide Openeye Name: N-butyl-3-(7-chloro-4-oxo-2-thioxo-1H-quinazolin-3-yl)benzamide CAS Name: N-butyl-3-(7-chloro-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)benzamide IUPAC Name: N-butyl-3-(7-chloro-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)benzamide Traditional Name: N-butyl-3-(7-chloro-4-keto-2-thioxo-1H-quinazolin-3-yl)benzamide Formula: C19H18ClN3O2S MolecularWeight: 387.88312

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC(=CC=C1)N2C(=O)C3=C(C=C(C=C3)Cl)NC2=S

Isomeric SMILES

CCCCNC(=O)C1=CC(=CC=C1)N2C(=O)C3=C(C=C(C=C3)Cl)NC2=S

InChI

InChI=1S/C19H18ClN3O2S/c1-2-3-9-21-17(24)12-5-4-6-14(10-12)23-18(25)15-8-7-13(20)11-16(15)22-19(23)26/h4-8,10-11H,2-3,9H2,1H3,(H,21,24)(H,22,26)