2-[[2-[(4-methylphenyl)amino]-1,3-thiazol-4-yl]methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-[[2-[(4-methylphenyl)amino]-1,3-thiazol-4-yl]methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-[[2-(4-methylanilino)thiazol-4-yl]methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-[[2-(4-methylanilino)-4-thiazolyl]methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-[[2-(4-methylanilino)-1,3-thiazol-4-yl]methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-[[2-(p-toluidino)thiazol-4-yl]methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C21H22N4OS MolecularWeight: 378.49058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=CS2)CN3CC4=CC=CC=C4CC3C(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=CS2)CN3CC4=CC=CC=C4CC3C(=O)N

InChI

InChI=1S/C21H22N4OS/c1-14-6-8-17(9-7-14)23-21-24-18(13-27-21)12-25-11-16-5-3-2-4-15(16)10-19(25)20(22)26/h2-9,13,19H,10-12H2,1H3,(H2,22,26)(H,23,24)