1-[4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-1,3-thiazol-2-yl]-3-(3-methylphenyl)urea

Systemtic Name: 1-[4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-1,3-thiazol-2-yl]-3-(3-methylphenyl)urea Openeye Name: 1-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)thiazol-2-yl]-3-(m-tolyl)urea CAS Name: 1-[4-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-2-thiazolyl]-3-(3-methylphenyl)urea IUPAC Name: 1-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-1,3-thiazol-2-yl]-3-(3-methylphenyl)urea Traditional Name: 1-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)thiazol-2-yl]-3-(m-tolyl)urea Formula: C21H20N4O2S MolecularWeight: 392.4741

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NC2=NC(=CS2)C(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NC2=NC(=CS2)C(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C21H20N4O2S/c1-14-5-4-8-17(11-14)22-20(27)24-21-23-18(13-28-21)19(26)25-10-9-15-6-2-3-7-16(15)12-25/h2-8,11,13H,9-10,12H2,1H3,(H2,22,23,24,27)