1-[(E)-1-[4-(furan-2-ylmethylsulfamoyl)phenyl]ethylideneamino]-3-(phenylmethyl)thiourea

Systemtic Name: 1-[(E)-1-[4-(furan-2-ylmethylsulfamoyl)phenyl]ethylideneamino]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[(E)-1-[4-(2-furylmethylsulfamoyl)phenyl]ethylideneamino]thiourea CAS Name: 1-[(E)-1-[4-(2-furanylmethylsulfamoyl)phenyl]ethylideneamino]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[(E)-1-[4-(furan-2-ylmethylsulfamoyl)phenyl]ethylideneamino]thiourea Traditional Name: 1-benzyl-3-[(E)-1-[4-(2-furfurylsulfamoyl)phenyl]ethylideneamino]thiourea Formula: C21H22N4O3S2 MolecularWeight: 442.55438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NCC1=CC=CC=C1)C2=CC=C(C=C2)S(=O)(=O)NCC3=CC=CO3

Isomeric SMILES

C/C(=N\NC(=S)NCC1=CC=CC=C1)/C2=CC=C(C=C2)S(=O)(=O)NCC3=CC=CO3

InChI

InChI=1S/C21H22N4O3S2/c1-16(24-25-21(29)22-14-17-6-3-2-4-7-17)18-9-11-20(12-10-18)30(26,27)23-15-19-8-5-13-28-19/h2-13,23H,14-15H2,1H3,(H2,22,25,29)/b24-16+