1-(2-chlorophenyl)-3-[(2-thiophen-2-ylquinolin-4-yl)carbonylamino]thiourea

Systemtic Name: 1-(2-chlorophenyl)-3-[(2-thiophen-2-ylquinolin-4-yl)carbonylamino]thiourea Openeye Name: 1-(2-chlorophenyl)-3-[[2-(2-thienyl)quinoline-4-carbonyl]amino]thiourea CAS Name: 1-(2-chlorophenyl)-3-[[oxo-(2-thiophen-2-yl-4-quinolinyl)methyl]amino]thiourea IUPAC Name: 1-(2-chlorophenyl)-3-[(2-thiophen-2-ylquinoline-4-carbonyl)amino]thiourea Traditional Name: 1-(2-chlorophenyl)-3-[[2-(2-thienyl)quinoline-4-carbonyl]amino]thiourea Formula: C21H15ClN4OS2 MolecularWeight: 438.953

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)NNC(=S)NC4=CC=CC=C4Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)NNC(=S)NC4=CC=CC=C4Cl

InChI

InChI=1S/C21H15ClN4OS2/c22-15-7-2-4-9-17(15)24-21(28)26-25-20(27)14-12-18(19-10-5-11-29-19)23-16-8-3-1-6-13(14)16/h1-12H,(H,25,27)(H2,24,26,28)