2-[3-(3-chloranyl-2-methyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[2-(cyclohexen-1-yl)ethyl]ethanamide

Systemtic Name: 2-[3-(3-chloranyl-2-methyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[2-(cyclohexen-1-yl)ethyl]ethanamide Openeye Name: 2-[3-(3-chloro-2-methyl-phenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-[2-(cyclohexen-1-yl)ethyl]acetamide CAS Name: 2-[[3-(3-chloro-2-methylphenyl)-4-oxo-2-quinazolinyl]thio]-N-[2-(1-cyclohexenyl)ethyl]acetamide IUPAC Name: 2-[3-(3-chloro-2-methylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-[2-(cyclohexen-1-yl)ethyl]acetamide Traditional Name: 2-[[3-(3-chloro-2-methyl-phenyl)-4-keto-quinazolin-2-yl]thio]-N-[2-(cyclohexen-1-yl)ethyl]acetamide Formula: C25H26ClN3O2S MolecularWeight: 468.01084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NCCC4=CCCCC4

Isomeric SMILES

CC1=C(C=CC=C1Cl)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NCCC4=CCCCC4

InChI

InChI=1S/C25H26ClN3O2S/c1-17-20(26)11-7-13-22(17)29-24(31)19-10-5-6-12-21(19)28-25(29)32-16-23(30)27-15-14-18-8-3-2-4-9-18/h5-8,10-13H,2-4,9,14-16H2,1H3,(H,27,30)