N-[(1,3-diphenylpyrazol-4-yl)methyl]-2-[(2R)-3-oxidanylidene-4H-1,4-benzothiazin-2-yl]ethanamide

Systemtic Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-2-[(2R)-3-oxidanylidene-4H-1,4-benzothiazin-2-yl]ethanamide Openeye Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-2-[(2R)-3-oxo-4H-1,4-benzothiazin-2-yl]acetamide CAS Name: N-[(1,3-diphenyl-4-pyrazolyl)methyl]-2-[(2R)-3-oxo-4H-1,4-benzothiazin-2-yl]acetamide IUPAC Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-2-[(2R)-3-oxo-4H-1,4-benzothiazin-2-yl]acetamide Traditional Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-2-[(2R)-3-keto-4H-1,4-benzothiazin-2-yl]acetamide Formula: C26H22N4O2S MolecularWeight: 454.54348

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2CNC(=O)CC3C(=O)NC4=CC=CC=C4S3)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2CNC(=O)C[C@@H]3C(=O)NC4=CC=CC=C4S3)C5=CC=CC=C5

InChI

InChI=1S/C26H22N4O2S/c31-24(15-23-26(32)28-21-13-7-8-14-22(21)33-23)27-16-19-17-30(20-11-5-2-6-12-20)29-25(19)18-9-3-1-4-10-18/h1-14,17,23H,15-16H2,(H,27,31)(H,28,32)/t23-/m1/s1