N-(3-acetamidophenyl)-2-[7-chloranyl-3-(3-methylbutyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: N-(3-acetamidophenyl)-2-[7-chloranyl-3-(3-methylbutyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide Openeye Name: N-(3-acetamidophenyl)-2-(7-chloro-3-isopentyl-4-oxo-quinazolin-2-yl)sulfanyl-propanamide CAS Name: N-(3-acetamidophenyl)-2-[[7-chloro-3-(3-methylbutyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: N-(3-acetamidophenyl)-2-[7-chloro-3-(3-methylbutyl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: N-(3-acetamidophenyl)-2-[(7-chloro-3-isoamyl-4-keto-quinazolin-2-yl)thio]propionamide Formula: C24H27ClN4O3S MolecularWeight: 487.01418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SC(C)C(=O)NC3=CC=CC(=C3)NC(=O)C

Isomeric SMILES

CC(C)CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SC(C)C(=O)NC3=CC=CC(=C3)NC(=O)C

InChI

InChI=1S/C24H27ClN4O3S/c1-14(2)10-11-29-23(32)20-9-8-17(25)12-21(20)28-24(29)33-15(3)22(31)27-19-7-5-6-18(13-19)26-16(4)30/h5-9,12-15H,10-11H2,1-4H3,(H,26,30)(H,27,31)