4-[(2,5-dimethylphenyl)methyl]-3-oxidanylidene-N-phenethyl-1,4-benzothiazine-6-carboxamide

Systemtic Name: 4-[(2,5-dimethylphenyl)methyl]-3-oxidanylidene-N-phenethyl-1,4-benzothiazine-6-carboxamide Openeye Name: 4-[(2,5-dimethylphenyl)methyl]-3-oxo-N-phenethyl-1,4-benzothiazine-6-carboxamide CAS Name: 4-[(2,5-dimethylphenyl)methyl]-3-oxo-N-phenethyl-1,4-benzothiazine-6-carboxamide IUPAC Name: 4-[(2,5-dimethylphenyl)methyl]-3-oxo-N-phenethyl-1,4-benzothiazine-6-carboxamide Traditional Name: 4-(2,5-dimethylbenzyl)-3-keto-N-phenethyl-1,4-benzothiazine-6-carboxamide Formula: C26H26N2O2S MolecularWeight: 430.56184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CN2C(=O)CSC3=C2C=C(C=C3)C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(C=C1)C)CN2C(=O)CSC3=C2C=C(C=C3)C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C26H26N2O2S/c1-18-8-9-19(2)22(14-18)16-28-23-15-21(10-11-24(23)31-17-25(28)29)26(30)27-13-12-20-6-4-3-5-7-20/h3-11,14-15H,12-13,16-17H2,1-2H3,(H,27,30)