1-[2-(phenylcarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-(thiophen-2-ylmethyl)urea

Systemtic Name: 1-[2-(phenylcarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-(thiophen-2-ylmethyl)urea Openeye Name: 1-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(2-thienylmethyl)urea CAS Name: 1-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(thiophen-2-ylmethyl)urea IUPAC Name: 1-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(thiophen-2-ylmethyl)urea Traditional Name: 1-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(2-thenyl)urea Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C=CC(=C2)NC(=O)NCC3=CC=CS3)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC2=C1C=CC(=C2)NC(=O)NCC3=CC=CS3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H21N3O2S/c26-21(17-5-2-1-3-6-17)25-11-10-16-8-9-19(13-18(16)15-25)24-22(27)23-14-20-7-4-12-28-20/h1-9,12-13H,10-11,14-15H2,(H2,23,24,27)