6-[(2R)-2-[6-chloranyl-3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanoyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[(2R)-2-[6-chloranyl-3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanoyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[(2R)-2-(6-chloro-3-isobutyl-4-oxo-quinazolin-2-yl)sulfanylpropanoyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[(2R)-2-[[6-chloro-3-(2-methylpropyl)-4-oxo-2-quinazolinyl]thio]-1-oxopropyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[(2R)-2-[6-chloro-3-(2-methylpropyl)-4-oxoquinazolin-2-yl]sulfanylpropanoyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[(2R)-2-[(6-chloro-3-isobutyl-4-keto-quinazolin-2-yl)thio]propanoyl]-4H-1,4-benzoxazin-3-one Formula: C23H22ClN3O4S MolecularWeight: 471.95648

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C=CC(=C2)Cl)N=C1SC(C)C(=O)C3=CC4=C(C=C3)OCC(=O)N4

Isomeric SMILES

C[C@H](C(=O)C1=CC2=C(C=C1)OCC(=O)N2)SC3=NC4=C(C=C(C=C4)Cl)C(=O)N3CC(C)C

InChI

InChI=1S/C23H22ClN3O4S/c1-12(2)10-27-22(30)16-9-15(24)5-6-17(16)26-23(27)32-13(3)21(29)14-4-7-19-18(8-14)25-20(28)11-31-19/h4-9,12-13H,10-11H2,1-3H3,(H,25,28)/t13-/m1/s1