N-(1,3-benzothiazol-2-yl)-2-(phenylcarbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-(phenylcarbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-benzoyl-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-benzoyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-benzoyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-benzoyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C24H19N3O2S MolecularWeight: 413.49156

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC2=CC=CC=C21)C(=O)C3=CC=CC=C3)C(=O)NC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1C(N(CC2=CC=CC=C21)C(=O)C3=CC=CC=C3)C(=O)NC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C24H19N3O2S/c28-22(26-24-25-19-12-6-7-13-21(19)30-24)20-14-17-10-4-5-11-18(17)15-27(20)23(29)16-8-2-1-3-9-16/h1-13,20H,14-15H2,(H,25,26,28)