2-(7-chloranyl-4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-N-[2-(cyclohexen-1-yl)ethyl]propanamide

Systemtic Name: 2-(7-chloranyl-4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-N-[2-(cyclohexen-1-yl)ethyl]propanamide Openeye Name: 2-(7-chloro-3-isopropyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[2-(cyclohexen-1-yl)ethyl]propanamide CAS Name: 2-[(7-chloro-4-oxo-3-propan-2-yl-2-quinazolinyl)thio]-N-[2-(1-cyclohexenyl)ethyl]propanamide IUPAC Name: 2-(7-chloro-4-oxo-3-propan-2-ylquinazolin-2-yl)sulfanyl-N-[2-(cyclohexen-1-yl)ethyl]propanamide Traditional Name: 2-[(7-chloro-3-isopropyl-4-keto-quinazolin-2-yl)thio]-N-[2-(cyclohexen-1-yl)ethyl]propionamide Formula: C22H28ClN3O2S MolecularWeight: 433.99462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=C(C=C(C=C2)Cl)N=C1SC(C)C(=O)NCCC3=CCCCC3

Isomeric SMILES

CC(C)N1C(=O)C2=C(C=C(C=C2)Cl)N=C1SC(C)C(=O)NCCC3=CCCCC3

InChI

InChI=1S/C22H28ClN3O2S/c1-14(2)26-21(28)18-10-9-17(23)13-19(18)25-22(26)29-15(3)20(27)24-12-11-16-7-5-4-6-8-16/h7,9-10,13-15H,4-6,8,11-12H2,1-3H3,(H,24,27)