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

Systemtic Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylpyrrol-2-yl)ethyl]-3-(thiophen-2-ylmethyl)urea Openeye Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylpyrrol-2-yl)ethyl]-3-(2-thienylmethyl)urea CAS Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methyl-2-pyrrolyl)ethyl]-3-(thiophen-2-ylmethyl)urea IUPAC Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylpyrrol-2-yl)ethyl]-3-(thiophen-2-ylmethyl)urea Traditional Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylpyrrol-2-yl)ethyl]-3-(2-thenyl)urea Formula: C22H26N4OS MolecularWeight: 394.53304

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(CNC(=O)NCC2=CC=CS2)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CN1C=CC=C1C(CNC(=O)NCC2=CC=CS2)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C22H26N4OS/c1-25-11-4-9-20(25)21(15-24-22(27)23-14-19-8-5-13-28-19)26-12-10-17-6-2-3-7-18(17)16-26/h2-9,11,13,21H,10,12,14-16H2,1H3,(H2,23,24,27)