N-[4-[(4-methylphenyl)methyl]-3-oxidanylidene-1,4-benzothiazin-6-yl]azepane-1-carboxamide

Systemtic Name: N-[4-[(4-methylphenyl)methyl]-3-oxidanylidene-1,4-benzothiazin-6-yl]azepane-1-carboxamide Openeye Name: N-[3-oxo-4-(p-tolylmethyl)-1,4-benzothiazin-6-yl]azepane-1-carboxamide CAS Name: N-[4-[(4-methylphenyl)methyl]-3-oxo-1,4-benzothiazin-6-yl]-1-azepanecarboxamide IUPAC Name: N-[4-[(4-methylphenyl)methyl]-3-oxo-1,4-benzothiazin-6-yl]azepane-1-carboxamide Traditional Name: N-[3-keto-4-(4-methylbenzyl)-1,4-benzothiazin-6-yl]azepane-1-carboxamide Formula: C23H27N3O2S MolecularWeight: 409.54438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=O)CSC3=C2C=C(C=C3)NC(=O)N4CCCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=O)CSC3=C2C=C(C=C3)NC(=O)N4CCCCCC4

InChI

InChI=1S/C23H27N3O2S/c1-17-6-8-18(9-7-17)15-26-20-14-19(10-11-21(20)29-16-22(26)27)24-23(28)25-12-4-2-3-5-13-25/h6-11,14H,2-5,12-13,15-16H2,1H3,(H,24,28)