2-[7-chloranyl-3-(3-methylbutyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-ethyl-6-methyl-phenyl)ethanamide

Systemtic Name: 2-[7-chloranyl-3-(3-methylbutyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-ethyl-6-methyl-phenyl)ethanamide Openeye Name: 2-(7-chloro-3-isopentyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(2-ethyl-6-methyl-phenyl)acetamide CAS Name: 2-[[7-chloro-3-(3-methylbutyl)-4-oxo-2-quinazolinyl]thio]-N-(2-ethyl-6-methylphenyl)acetamide IUPAC Name: 2-[7-chloro-3-(3-methylbutyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(2-ethyl-6-methylphenyl)acetamide Traditional Name: 2-[(7-chloro-3-isoamyl-4-keto-quinazolin-2-yl)thio]-N-(2-ethyl-6-methyl-phenyl)acetamide Formula: C24H28ClN3O2S MolecularWeight: 458.01602

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CCC(C)C)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CCC(C)C)C

InChI

InChI=1S/C24H28ClN3O2S/c1-5-17-8-6-7-16(4)22(17)27-21(29)14-31-24-26-20-13-18(25)9-10-19(20)23(30)28(24)12-11-15(2)3/h6-10,13,15H,5,11-12,14H2,1-4H3,(H,27,29)