1-(2,4-dichlorophenyl)-3-[[4-(prop-2-ynylsulfamoyl)phenyl]carbonylamino]thiourea

Systemtic Name: 1-(2,4-dichlorophenyl)-3-[[4-(prop-2-ynylsulfamoyl)phenyl]carbonylamino]thiourea Openeye Name: 1-(2,4-dichlorophenyl)-3-[[4-(prop-2-ynylsulfamoyl)benzoyl]amino]thiourea CAS Name: 1-(2,4-dichlorophenyl)-3-[[oxo-[4-(prop-2-ynylsulfamoyl)phenyl]methyl]amino]thiourea IUPAC Name: 1-(2,4-dichlorophenyl)-3-[[4-(prop-2-ynylsulfamoyl)benzoyl]amino]thiourea Traditional Name: 1-(2,4-dichlorophenyl)-3-[[4-(propargylsulfamoyl)benzoyl]amino]thiourea Formula: C17H14Cl2N4O3S2 MolecularWeight: 457.35406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CCNS(=O)(=O)C1=CC=C(C=C1)C(=O)NNC(=S)NC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

C#CCNS(=O)(=O)C1=CC=C(C=C1)C(=O)NNC(=S)NC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C17H14Cl2N4O3S2/c1-2-9-20-28(25,26)13-6-3-11(4-7-13)16(24)22-23-17(27)21-15-8-5-12(18)10-14(15)19/h1,3-8,10,20H,9H2,(H,22,24)(H2,21,23,27)