N-(3-ethoxypropyl)-4-[(4-methylphenyl)methyl]-3-oxidanylidene-1,4-benzothiazine-6-carboxamide

Systemtic Name: N-(3-ethoxypropyl)-4-[(4-methylphenyl)methyl]-3-oxidanylidene-1,4-benzothiazine-6-carboxamide Openeye Name: N-(3-ethoxypropyl)-3-oxo-4-(p-tolylmethyl)-1,4-benzothiazine-6-carboxamide CAS Name: N-(3-ethoxypropyl)-4-[(4-methylphenyl)methyl]-3-oxo-1,4-benzothiazine-6-carboxamide IUPAC Name: N-(3-ethoxypropyl)-4-[(4-methylphenyl)methyl]-3-oxo-1,4-benzothiazine-6-carboxamide Traditional Name: N-(3-ethoxypropyl)-3-keto-4-(4-methylbenzyl)-1,4-benzothiazine-6-carboxamide Formula: C22H26N2O3S MolecularWeight: 398.51844

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=O)C1=CC2=C(C=C1)SCC(=O)N2CC3=CC=C(C=C3)C

Isomeric SMILES

CCOCCCNC(=O)C1=CC2=C(C=C1)SCC(=O)N2CC3=CC=C(C=C3)C

InChI

InChI=1S/C22H26N2O3S/c1-3-27-12-4-11-23-22(26)18-9-10-20-19(13-18)24(21(25)15-28-20)14-17-7-5-16(2)6-8-17/h5-10,13H,3-4,11-12,14-15H2,1-2H3,(H,23,26)