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

Systemtic Name: 1-(3,4-dichlorophenyl)-3-(2-thiophen-2-ylcarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)urea Openeye Name: 1-(3,4-dichlorophenyl)-3-[2-(thiophene-2-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea CAS Name: 1-(3,4-dichlorophenyl)-3-[2-[oxo(thiophen-2-yl)methyl]-3,4-dihydro-1H-isoquinolin-7-yl]urea IUPAC Name: 1-(3,4-dichlorophenyl)-3-[2-(thiophene-2-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea Traditional Name: 1-(3,4-dichlorophenyl)-3-[2-(2-thenoyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea Formula: C21H17Cl2N3O2S MolecularWeight: 446.34958

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C=CC(=C2)NC(=O)NC3=CC(=C(C=C3)Cl)Cl)C(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CC2=C1C=CC(=C2)NC(=O)NC3=CC(=C(C=C3)Cl)Cl)C(=O)C4=CC=CS4

InChI

InChI=1S/C21H17Cl2N3O2S/c22-17-6-5-16(11-18(17)23)25-21(28)24-15-4-3-13-7-8-26(12-14(13)10-15)20(27)19-2-1-9-29-19/h1-6,9-11H,7-8,12H2,(H2,24,25,28)