(2R)-N-aminocarbonyl-2-[7-chloranyl-3-(2-methoxy-5-methyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-3-methyl-butanamide

Systemtic Name: (2R)-N-aminocarbonyl-2-[7-chloranyl-3-(2-methoxy-5-methyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-3-methyl-butanamide Openeye Name: (2R)-N-carbamoyl-2-[7-chloro-3-(2-methoxy-5-methyl-phenyl)-4-oxo-quinazolin-2-yl]sulfanyl-3-methyl-butanamide CAS Name: (2R)-N-carbamoyl-2-[[7-chloro-3-(2-methoxy-5-methylphenyl)-4-oxo-2-quinazolinyl]thio]-3-methylbutanamide IUPAC Name: (2R)-N-carbamoyl-2-[7-chloro-3-(2-methoxy-5-methylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-3-methylbutanamide Traditional Name: (2R)-N-carbamoyl-2-[[7-chloro-4-keto-3-(2-methoxy-5-methyl-phenyl)quinazolin-2-yl]thio]-3-methyl-butyramide Formula: C22H23ClN4O4S MolecularWeight: 474.96042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SC(C(C)C)C(=O)NC(=O)N

Isomeric SMILES

CC1=CC(=C(C=C1)OC)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2S[C@H](C(C)C)C(=O)NC(=O)N

InChI

InChI=1S/C22H23ClN4O4S/c1-11(2)18(19(28)26-21(24)30)32-22-25-15-10-13(23)6-7-14(15)20(29)27(22)16-9-12(3)5-8-17(16)31-4/h5-11,18H,1-4H3,(H3,24,26,28,30)/t18-/m1/s1