N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(phenylmethyl)-2,3-dihydro-1,4-benzothiazine-6-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(phenylmethyl)-2,3-dihydro-1,4-benzothiazine-6-carboxamide Openeye Name: 4-benzyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-2,3-dihydro-1,4-benzothiazine-6-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(phenylmethyl)-2,3-dihydro-1,4-benzothiazine-6-carboxamide IUPAC Name: 4-benzyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-2,3-dihydro-1,4-benzothiazine-6-carboxamide Traditional Name: 4-benzyl-N-homoveratryl-2,3-dihydro-1,4-benzothiazine-6-carboxamide Formula: C26H28N2O3S MolecularWeight: 448.57712

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=CC3=C(C=C2)SCCN3CC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=CC3=C(C=C2)SCCN3CC4=CC=CC=C4)OC

InChI

InChI=1S/C26H28N2O3S/c1-30-23-10-8-19(16-24(23)31-2)12-13-27-26(29)21-9-11-25-22(17-21)28(14-15-32-25)18-20-6-4-3-5-7-20/h3-11,16-17H,12-15,18H2,1-2H3,(H,27,29)