2-(3,4-dihydro-2H-quinolin-1-yl)-N-[(4-methoxyphenyl)methyl]-1,3-benzothiazole-4-carboxamide

Systemtic Name: 2-(3,4-dihydro-2H-quinolin-1-yl)-N-[(4-methoxyphenyl)methyl]-1,3-benzothiazole-4-carboxamide Openeye Name: 2-(3,4-dihydro-2H-quinolin-1-yl)-N-[(4-methoxyphenyl)methyl]-1,3-benzothiazole-4-carboxamide CAS Name: 2-(3,4-dihydro-2H-quinolin-1-yl)-N-[(4-methoxyphenyl)methyl]-1,3-benzothiazole-4-carboxamide IUPAC Name: 2-(3,4-dihydro-2H-quinolin-1-yl)-N-[(4-methoxyphenyl)methyl]-1,3-benzothiazole-4-carboxamide Traditional Name: 2-(3,4-dihydro-2H-quinolin-1-yl)-N-p-anisyl-1,3-benzothiazole-4-carboxamide Formula: C25H23N3O2S MolecularWeight: 429.53402

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)C2=C3C(=CC=C2)SC(=N3)N4CCCC5=CC=CC=C54

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)C2=C3C(=CC=C2)SC(=N3)N4CCCC5=CC=CC=C54

InChI

InChI=1S/C25H23N3O2S/c1-30-19-13-11-17(12-14-19)16-26-24(29)20-8-4-10-22-23(20)27-25(31-22)28-15-5-7-18-6-2-3-9-21(18)28/h2-4,6,8-14H,5,7,15-16H2,1H3,(H,26,29)