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

Systemtic Name: 1-[[4-(2-cyanoethylsulfamoyl)phenyl]carbonylamino]-3-(2,4-dichlorophenyl)thiourea Openeye Name: 1-[[4-(2-cyanoethylsulfamoyl)benzoyl]amino]-3-(2,4-dichlorophenyl)thiourea CAS Name: 1-[[[4-(2-cyanoethylsulfamoyl)phenyl]-oxomethyl]amino]-3-(2,4-dichlorophenyl)thiourea IUPAC Name: 1-[[4-(2-cyanoethylsulfamoyl)benzoyl]amino]-3-(2,4-dichlorophenyl)thiourea Traditional Name: 1-[[4-(2-cyanoethylsulfamoyl)benzoyl]amino]-3-(2,4-dichlorophenyl)thiourea Formula: C17H15Cl2N5O3S2 MolecularWeight: 472.3687

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NNC(=S)NC2=C(C=C(C=C2)Cl)Cl)S(=O)(=O)NCCC#N

Isomeric SMILES

C1=CC(=CC=C1C(=O)NNC(=S)NC2=C(C=C(C=C2)Cl)Cl)S(=O)(=O)NCCC#N

InChI

InChI=1S/C17H15Cl2N5O3S2/c18-12-4-7-15(14(19)10-12)22-17(28)24-23-16(25)11-2-5-13(6-3-11)29(26,27)21-9-1-8-20/h2-7,10,21H,1,9H2,(H,23,25)(H2,22,24,28)