4-[3-(2,4-dichlorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-pyridin-2-ylethyl)butanamide

Systemtic Name: 4-[3-(2,4-dichlorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-pyridin-2-ylethyl)butanamide Openeye Name: 4-[3-(2,4-dichlorophenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-[2-(2-pyridyl)ethyl]butanamide CAS Name: 4-[[3-(2,4-dichlorophenyl)-4-oxo-2-quinazolinyl]thio]-N-[2-(2-pyridinyl)ethyl]butanamide IUPAC Name: 4-[3-(2,4-dichlorophenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(2-pyridin-2-ylethyl)butanamide Traditional Name: 4-[[3-(2,4-dichlorophenyl)-4-keto-quinazolin-2-yl]thio]-N-[2-(2-pyridyl)ethyl]butyramide Formula: C25H22Cl2N4O2S MolecularWeight: 513.43878

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCCCC(=O)NCCC3=CC=CC=N3)C4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCCCC(=O)NCCC3=CC=CC=N3)C4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C25H22Cl2N4O2S/c26-17-10-11-22(20(27)16-17)31-24(33)19-7-1-2-8-21(19)30-25(31)34-15-5-9-23(32)29-14-12-18-6-3-4-13-28-18/h1-4,6-8,10-11,13,16H,5,9,12,14-15H2,(H,29,32)