N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[(4-methylphenyl)methyl]-3-oxidanylidene-1,4-benzothiazine-6-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[(4-methylphenyl)methyl]-3-oxidanylidene-1,4-benzothiazine-6-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-oxo-4-(p-tolylmethyl)-1,4-benzothiazine-6-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[(4-methylphenyl)methyl]-3-oxo-1,4-benzothiazine-6-carboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[(4-methylphenyl)methyl]-3-oxo-1,4-benzothiazine-6-carboxamide Traditional Name: N-homoveratryl-3-keto-4-(4-methylbenzyl)-1,4-benzothiazine-6-carboxamide Formula: C27H28N2O4S MolecularWeight: 476.58722

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H28N2O4S/c1-18-4-6-20(7-5-18)16-29-22-15-21(9-11-25(22)34-17-26(29)30)27(31)28-13-12-19-8-10-23(32-2)24(14-19)33-3/h4-11,14-15H,12-13,16-17H2,1-3H3,(H,28,31)