1-(3-phenylpropyl)-3-(2-thiophen-2-ylcarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)urea

Systemtic Name: 1-(3-phenylpropyl)-3-(2-thiophen-2-ylcarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)urea Openeye Name: 1-(3-phenylpropyl)-3-[2-(thiophene-2-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea CAS Name: 1-[2-[oxo(thiophen-2-yl)methyl]-3,4-dihydro-1H-isoquinolin-7-yl]-3-(3-phenylpropyl)urea IUPAC Name: 1-(3-phenylpropyl)-3-[2-(thiophene-2-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea Traditional Name: 1-(3-phenylpropyl)-3-[2-(2-thenoyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea Formula: C24H25N3O2S MolecularWeight: 419.5392

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C=CC(=C2)NC(=O)NCCCC3=CC=CC=C3)C(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CC2=C1C=CC(=C2)NC(=O)NCCCC3=CC=CC=C3)C(=O)C4=CC=CS4

InChI

InChI=1S/C24H25N3O2S/c28-23(22-9-5-15-30-22)27-14-12-19-10-11-21(16-20(19)17-27)26-24(29)25-13-4-8-18-6-2-1-3-7-18/h1-3,5-7,9-11,15-16H,4,8,12-14,17H2,(H2,25,26,29)