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

Systemtic Name: N-(3-methyl-1,3-benzothiazol-2-ylidene)-2-(phenylcarbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-benzoyl-N-(3-methyl-1,3-benzothiazol-2-ylidene)-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-benzoyl-N-(3-methyl-1,3-benzothiazol-2-ylidene)-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-benzoyl-N-(3-methyl-1,3-benzothiazol-2-ylidene)-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-benzoyl-N-(3-methyl-1,3-benzothiazol-2-ylidene)-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C25H21N3O2S MolecularWeight: 427.51814

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2SC1=NC(=O)C3CC4=CC=CC=C4CN3C(=O)C5=CC=CC=C5

Isomeric SMILES

CN1C2=CC=CC=C2SC1=NC(=O)C3CC4=CC=CC=C4CN3C(=O)C5=CC=CC=C5

InChI

InChI=1S/C25H21N3O2S/c1-27-20-13-7-8-14-22(20)31-25(27)26-23(29)21-15-18-11-5-6-12-19(18)16-28(21)24(30)17-9-3-2-4-10-17/h2-14,21H,15-16H2,1H3