1-[[2-[(4-chlorophenyl)sulfamoyl]-4-nitro-phenyl]amino]-3-(furan-2-ylmethyl)thiourea

Systemtic Name: 1-[[2-[(4-chlorophenyl)sulfamoyl]-4-nitro-phenyl]amino]-3-(furan-2-ylmethyl)thiourea Openeye Name: 1-[2-[(4-chlorophenyl)sulfamoyl]-4-nitro-anilino]-3-(2-furylmethyl)thiourea CAS Name: 1-[2-[(4-chlorophenyl)sulfamoyl]-4-nitroanilino]-3-(2-furanylmethyl)thiourea IUPAC Name: 1-[2-[(4-chlorophenyl)sulfamoyl]-4-nitroanilino]-3-(furan-2-ylmethyl)thiourea Traditional Name: 1-[2-[(4-chlorophenyl)sulfamoyl]-4-nitro-anilino]-3-(2-furfuryl)thiourea Formula: C18H16ClN5O5S2 MolecularWeight: 481.93314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CNC(=S)NNC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)NC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=COC(=C1)CNC(=S)NNC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H16ClN5O5S2/c19-12-3-5-13(6-4-12)23-31(27,28)17-10-14(24(25)26)7-8-16(17)21-22-18(30)20-11-15-2-1-9-29-15/h1-10,21,23H,11H2,(H2,20,22,30)