1-(4-methylphenyl)-5-phenyl-3-[(2E)-2-(phenylhydrazinylidene)-1,4-benzothiazin-3-yl]pyrazole-4-carbonitrile

Systemtic Name: 1-(4-methylphenyl)-5-phenyl-3-[(2E)-2-(phenylhydrazinylidene)-1,4-benzothiazin-3-yl]pyrazole-4-carbonitrile Openeye Name: 5-phenyl-3-[(2E)-2-(phenylhydrazono)-1,4-benzothiazin-3-yl]-1-(p-tolyl)pyrazole-4-carbonitrile CAS Name: 1-(4-methylphenyl)-5-phenyl-3-[(2E)-2-(phenylhydrazinylidene)-1,4-benzothiazin-3-yl]-4-pyrazolecarbonitrile IUPAC Name: 1-(4-methylphenyl)-5-phenyl-3-[(2E)-2-(phenylhydrazinylidene)-1,4-benzothiazin-3-yl]pyrazole-4-carbonitrile Traditional Name: 5-phenyl-3-[(2E)-2-(phenylhydrazono)-1,4-benzothiazin-3-yl]-1-(p-tolyl)pyrazole-4-carbonitrile Formula: C31H22N6S MolecularWeight: 510.61158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C(=N2)C3=NC4=CC=CC=C4SC3=NNC5=CC=CC=C5)C#N)C6=CC=CC=C6

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C(=N2)C\3=NC4=CC=CC=C4S/C3=N/NC5=CC=CC=C5)C#N)C6=CC=CC=C6

InChI

InChI=1S/C31H22N6S/c1-21-16-18-24(19-17-21)37-30(22-10-4-2-5-11-22)25(20-32)28(36-37)29-31(35-34-23-12-6-3-7-13-23)38-27-15-9-8-14-26(27)33-29/h2-19,34H,1H3/b35-31+