2-methylsulfonylethyl N-[(5Z)-5-(6-chloranyl-2-oxidanylidene-4-phenyl-quinolin-3-ylidene)-2H-1,2-oxazol-3-yl]carbamate

Systemtic Name: 2-methylsulfonylethyl N-[(5Z)-5-(6-chloranyl-2-oxidanylidene-4-phenyl-quinolin-3-ylidene)-2H-1,2-oxazol-3-yl]carbamate Openeye Name: 2-methylsulfonylethyl N-[(5Z)-5-(6-chloro-2-oxo-4-phenyl-3-quinolylidene)-2H-isoxazol-3-yl]carbamate CAS Name: N-[(5Z)-5-(6-chloro-2-oxo-4-phenyl-3-quinolinylidene)-2H-isoxazol-3-yl]carbamic acid 2-methylsulfonylethyl ester IUPAC Name: 2-methylsulfonylethyl N-[(5Z)-5-(6-chloro-2-oxo-4-phenylquinolin-3-ylidene)-2H-1,2-oxazol-3-yl]carbamate Traditional Name: N-[(5Z)-5-(6-chloro-2-keto-4-phenyl-3-quinolylidene)-3-isoxazolin-3-yl]carbamic acid 2-mesylethyl ester Formula: C22H18ClN3O6S MolecularWeight: 487.91282

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCOC(=O)NC1=CC(=C2C(=C3C=C(C=CC3=NC2=O)Cl)C4=CC=CC=C4)ON1

Isomeric SMILES

CS(=O)(=O)CCOC(=O)NC1=C/C(=C/2\C(=C3C=C(C=CC3=NC2=O)Cl)C4=CC=CC=C4)/ON1

InChI

InChI=1S/C22H18ClN3O6S/c1-33(29,30)10-9-31-22(28)25-18-12-17(32-26-18)20-19(13-5-3-2-4-6-13)15-11-14(23)7-8-16(15)24-21(20)27/h2-8,11-12,26H,9-10H2,1H3,(H,25,28)/b20-17-