N-[2-[(3-methylphenyl)methyl]pyrazol-3-yl]-3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanamide

Systemtic Name: N-[2-[(3-methylphenyl)methyl]pyrazol-3-yl]-3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanamide Openeye Name: N-[2-(m-tolylmethyl)pyrazol-3-yl]-3-(3-oxo-1,4-benzothiazin-4-yl)propanamide CAS Name: N-[2-[(3-methylphenyl)methyl]-3-pyrazolyl]-3-(3-oxo-1,4-benzothiazin-4-yl)propanamide IUPAC Name: N-[2-[(3-methylphenyl)methyl]pyrazol-3-yl]-3-(3-oxo-1,4-benzothiazin-4-yl)propanamide Traditional Name: 3-(3-keto-1,4-benzothiazin-4-yl)-N-[2-(3-methylbenzyl)pyrazol-3-yl]propionamide Formula: C22H22N4O2S MolecularWeight: 406.50068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C(=CC=N2)NC(=O)CCN3C(=O)CSC4=CC=CC=C43

Isomeric SMILES

CC1=CC(=CC=C1)CN2C(=CC=N2)NC(=O)CCN3C(=O)CSC4=CC=CC=C43

InChI

InChI=1S/C22H22N4O2S/c1-16-5-4-6-17(13-16)14-26-20(9-11-23-26)24-21(27)10-12-25-18-7-2-3-8-19(18)29-15-22(25)28/h2-9,11,13H,10,12,14-15H2,1H3,(H,24,27)