(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 2-[(4-chlorophenyl)sulfonyl-methyl-amino]ethanoate

Systemtic Name: (7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 2-[(4-chlorophenyl)sulfonyl-methyl-amino]ethanoate Openeye Name: (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl 2-[(4-chlorophenyl)sulfonyl-methyl-amino]acetate CAS Name: 2-[(4-chlorophenyl)sulfonyl-methylamino]acetic acid (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl 2-[(4-chlorophenyl)sulfonyl-methylamino]acetate Traditional Name: 2-[(4-chlorophenyl)sulfonyl-methyl-amino]acetic acid (7-chloro-4-keto-1H-quinazolin-2-yl)methyl ester Formula: C18H15Cl2N3O5S MolecularWeight: 456.2998

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)OCC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CN(CC(=O)OCC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H15Cl2N3O5S/c1-23(29(26,27)13-5-2-11(19)3-6-13)9-17(24)28-10-16-21-15-8-12(20)4-7-14(15)18(25)22-16/h2-8H,9-10H2,1H3,(H,21,22,25)