N-[4-azanyl-3,5-bis(chloranyl)phenyl]-6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide

Systemtic Name: N-[4-azanyl-3,5-bis(chloranyl)phenyl]-6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide Openeye Name: N-(4-amino-3,5-dichloro-phenyl)-6-(4-oxo-2-thioxo-1H-quinazolin-3-yl)hexanamide CAS Name: N-(4-amino-3,5-dichlorophenyl)-6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide IUPAC Name: N-(4-amino-3,5-dichlorophenyl)-6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide Traditional Name: N-(4-amino-3,5-dichloro-phenyl)-6-(4-keto-2-thioxo-1H-quinazolin-3-yl)hexanamide Formula: C20H20Cl2N4O2S MolecularWeight: 451.3694

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=S)N2)CCCCCC(=O)NC3=CC(=C(C(=C3)Cl)N)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=S)N2)CCCCCC(=O)NC3=CC(=C(C(=C3)Cl)N)Cl

InChI

InChI=1S/C20H20Cl2N4O2S/c21-14-10-12(11-15(22)18(14)23)24-17(27)8-2-1-5-9-26-19(28)13-6-3-4-7-16(13)25-20(26)29/h3-4,6-7,10-11H,1-2,5,8-9,23H2,(H,24,27)(H,25,29)