N-aminocarbonyl-2-[3-[2-(2,4-dichlorophenyl)ethyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-3-methyl-butanamide

Systemtic Name: N-aminocarbonyl-2-[3-[2-(2,4-dichlorophenyl)ethyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-3-methyl-butanamide Openeye Name: N-carbamoyl-2-[3-[2-(2,4-dichlorophenyl)ethyl]-4-oxo-quinazolin-2-yl]sulfanyl-3-methyl-butanamide CAS Name: N-carbamoyl-2-[[3-[2-(2,4-dichlorophenyl)ethyl]-4-oxo-2-quinazolinyl]thio]-3-methylbutanamide IUPAC Name: N-carbamoyl-2-[3-[2-(2,4-dichlorophenyl)ethyl]-4-oxoquinazolin-2-yl]sulfanyl-3-methylbutanamide Traditional Name: N-carbamoyl-2-[[3-[2-(2,4-dichlorophenyl)ethyl]-4-keto-quinazolin-2-yl]thio]-3-methyl-butyramide Formula: C22H22Cl2N4O3S MolecularWeight: 493.40608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(=O)N)SC1=NC2=CC=CC=C2C(=O)N1CCC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC(C)C(C(=O)NC(=O)N)SC1=NC2=CC=CC=C2C(=O)N1CCC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C22H22Cl2N4O3S/c1-12(2)18(19(29)27-21(25)31)32-22-26-17-6-4-3-5-15(17)20(30)28(22)10-9-13-7-8-14(23)11-16(13)24/h3-8,11-12,18H,9-10H2,1-2H3,(H3,25,27,29,31)