N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-(p-tolylsulfonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-tosyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C26H25N3O4S2 MolecularWeight: 507.6244

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CC4=CC=CC=C4CN3S(=O)(=O)C5=CC=C(C=C5)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CC4=CC=CC=C4CN3S(=O)(=O)C5=CC=C(C=C5)C

InChI

InChI=1S/C26H25N3O4S2/c1-3-33-20-10-13-22-24(15-20)34-26(27-22)28-25(30)23-14-18-6-4-5-7-19(18)16-29(23)35(31,32)21-11-8-17(2)9-12-21/h4-13,15,23H,3,14,16H2,1-2H3,(H,27,28,30)