1-[5-(diethylsulfamoyl)-2-methyl-phenyl]-3-[[2-(furan-2-yl)quinolin-4-yl]carbonylamino]thiourea

Systemtic Name: 1-[5-(diethylsulfamoyl)-2-methyl-phenyl]-3-[[2-(furan-2-yl)quinolin-4-yl]carbonylamino]thiourea Openeye Name: 1-[5-(diethylsulfamoyl)-2-methyl-phenyl]-3-[[2-(2-furyl)quinoline-4-carbonyl]amino]thiourea CAS Name: 1-[5-(diethylsulfamoyl)-2-methylphenyl]-3-[[[2-(2-furanyl)-4-quinolinyl]-oxomethyl]amino]thiourea IUPAC Name: 1-[5-(diethylsulfamoyl)-2-methylphenyl]-3-[[2-(furan-2-yl)quinoline-4-carbonyl]amino]thiourea Traditional Name: 1-[5-(diethylsulfamoyl)-2-methyl-phenyl]-3-[[2-(2-furyl)quinoline-4-carbonyl]amino]thiourea Formula: C26H27N5O4S2 MolecularWeight: 537.65368

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)NC(=S)NNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CO4

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)NC(=S)NNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CO4

InChI

InChI=1S/C26H27N5O4S2/c1-4-31(5-2)37(33,34)18-13-12-17(3)22(15-18)28-26(36)30-29-25(32)20-16-23(24-11-8-14-35-24)27-21-10-7-6-9-19(20)21/h6-16H,4-5H2,1-3H3,(H,29,32)(H2,28,30,36)