ethyl 5-methyl-1-[3-[3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanoylamino]phenyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 5-methyl-1-[3-[3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanoylamino]phenyl]pyrazole-4-carboxylate Openeye Name: ethyl 5-methyl-1-[3-[3-(3-oxo-1,4-benzothiazin-4-yl)propanoylamino]phenyl]pyrazole-4-carboxylate CAS Name: 5-methyl-1-[3-[[1-oxo-3-(3-oxo-1,4-benzothiazin-4-yl)propyl]amino]phenyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-1-[3-[3-(3-oxo-1,4-benzothiazin-4-yl)propanoylamino]phenyl]pyrazole-4-carboxylate Traditional Name: 1-[3-[3-(3-keto-1,4-benzothiazin-4-yl)propanoylamino]phenyl]-5-methyl-pyrazole-4-carboxylic acid ethyl ester Formula: C24H24N4O4S MolecularWeight: 464.53676

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC(=CC=C2)NC(=O)CCN3C(=O)CSC4=CC=CC=C43)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC(=CC=C2)NC(=O)CCN3C(=O)CSC4=CC=CC=C43)C

InChI

InChI=1S/C24H24N4O4S/c1-3-32-24(31)19-14-25-28(16(19)2)18-8-6-7-17(13-18)26-22(29)11-12-27-20-9-4-5-10-21(20)33-15-23(27)30/h4-10,13-14H,3,11-12,15H2,1-2H3,(H,26,29)