1-[(4-chlorophenyl)methyl]-3-(2-thiophen-2-ylcarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)urea

Systemtic Name: 1-[(4-chlorophenyl)methyl]-3-(2-thiophen-2-ylcarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)urea Openeye Name: 1-[(4-chlorophenyl)methyl]-3-[2-(thiophene-2-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea CAS Name: 1-[(4-chlorophenyl)methyl]-3-[2-[oxo(thiophen-2-yl)methyl]-3,4-dihydro-1H-isoquinolin-7-yl]urea IUPAC Name: 1-[(4-chlorophenyl)methyl]-3-[2-(thiophene-2-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea Traditional Name: 1-(4-chlorobenzyl)-3-[2-(2-thenoyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea Formula: C22H20ClN3O2S MolecularWeight: 425.9311

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C=CC(=C2)NC(=O)NCC3=CC=C(C=C3)Cl)C(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CC2=C1C=CC(=C2)NC(=O)NCC3=CC=C(C=C3)Cl)C(=O)C4=CC=CS4

InChI

InChI=1S/C22H20ClN3O2S/c23-18-6-3-15(4-7-18)13-24-22(28)25-19-8-5-16-9-10-26(14-17(16)12-19)21(27)20-2-1-11-29-20/h1-8,11-12H,9-10,13-14H2,(H2,24,25,28)