1-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-3-[(2-phenylquinolin-4-yl)carbonylamino]thiourea

Systemtic Name: 1-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-3-[(2-phenylquinolin-4-yl)carbonylamino]thiourea Openeye Name: 1-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-3-[(2-phenylquinoline-4-carbonyl)amino]thiourea CAS Name: 1-[5-(dimethylsulfamoyl)-2-methylphenyl]-3-[[oxo-(2-phenyl-4-quinolinyl)methyl]amino]thiourea IUPAC Name: 1-[5-(dimethylsulfamoyl)-2-methylphenyl]-3-[(2-phenylquinoline-4-carbonyl)amino]thiourea Traditional Name: 1-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-3-[(2-phenylquinoline-4-carbonyl)amino]thiourea Formula: C26H25N5O3S2 MolecularWeight: 519.6384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C)NC(=S)NNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C)NC(=S)NNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C26H25N5O3S2/c1-17-13-14-19(36(33,34)31(2)3)15-23(17)28-26(35)30-29-25(32)21-16-24(18-9-5-4-6-10-18)27-22-12-8-7-11-20(21)22/h4-16H,1-3H3,(H,29,32)(H2,28,30,35)