2-(3,4-dihydro-2H-quinolin-1-yl)-N-(pyridin-3-ylmethyl)-1,3-benzothiazole-4-carboxamide

Systemtic Name: 2-(3,4-dihydro-2H-quinolin-1-yl)-N-(pyridin-3-ylmethyl)-1,3-benzothiazole-4-carboxamide Openeye Name: 2-(3,4-dihydro-2H-quinolin-1-yl)-N-(3-pyridylmethyl)-1,3-benzothiazole-4-carboxamide CAS Name: 2-(3,4-dihydro-2H-quinolin-1-yl)-N-(3-pyridinylmethyl)-1,3-benzothiazole-4-carboxamide IUPAC Name: 2-(3,4-dihydro-2H-quinolin-1-yl)-N-(pyridin-3-ylmethyl)-1,3-benzothiazole-4-carboxamide Traditional Name: 2-(3,4-dihydro-2H-quinolin-1-yl)-N-(3-pyridylmethyl)-1,3-benzothiazole-4-carboxamide Formula: C23H20N4OS MolecularWeight: 400.4961

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C1)C3=NC4=C(C=CC=C4S3)C(=O)NCC5=CN=CC=C5

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)C3=NC4=C(C=CC=C4S3)C(=O)NCC5=CN=CC=C5

InChI

InChI=1S/C23H20N4OS/c28-22(25-15-16-6-4-12-24-14-16)18-9-3-11-20-21(18)26-23(29-20)27-13-5-8-17-7-1-2-10-19(17)27/h1-4,6-7,9-12,14H,5,8,13,15H2,(H,25,28)