1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylpyrrol-2-yl)ethyl]-3-thiophen-2-yl-urea

Systemtic Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylpyrrol-2-yl)ethyl]-3-thiophen-2-yl-urea Openeye Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylpyrrol-2-yl)ethyl]-3-(2-thienyl)urea CAS Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methyl-2-pyrrolyl)ethyl]-3-thiophen-2-ylurea IUPAC Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylpyrrol-2-yl)ethyl]-3-thiophen-2-ylurea Traditional Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylpyrrol-2-yl)ethyl]-3-(2-thienyl)urea Formula: C21H24N4OS MolecularWeight: 380.50646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(CNC(=O)NC2=CC=CS2)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CN1C=CC=C1C(CNC(=O)NC2=CC=CS2)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C21H24N4OS/c1-24-11-4-8-18(24)19(14-22-21(26)23-20-9-5-13-27-20)25-12-10-16-6-2-3-7-17(16)15-25/h2-9,11,13,19H,10,12,14-15H2,1H3,(H2,22,23,26)