1-[4-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]phenyl]-3-(2-ethoxyphenyl)thiourea

Systemtic Name: 1-[4-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]phenyl]-3-(2-ethoxyphenyl)thiourea Openeye Name: 1-[4-[(3,4-dimethylisoxazol-5-yl)sulfamoyl]phenyl]-3-(2-ethoxyphenyl)thiourea CAS Name: 1-[4-[(3,4-dimethyl-5-isoxazolyl)sulfamoyl]phenyl]-3-(2-ethoxyphenyl)thiourea IUPAC Name: 1-[4-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]phenyl]-3-(2-ethoxyphenyl)thiourea Traditional Name: 1-[4-[(3,4-dimethylisoxazol-5-yl)sulfamoyl]phenyl]-3-o-phenetyl-thiourea Formula: C20H22N4O4S2 MolecularWeight: 446.54308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=C(C(=NO3)C)C

Isomeric SMILES

CCOC1=CC=CC=C1NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=C(C(=NO3)C)C

InChI

InChI=1S/C20H22N4O4S2/c1-4-27-18-8-6-5-7-17(18)22-20(29)21-15-9-11-16(12-10-15)30(25,26)24-19-13(2)14(3)23-28-19/h5-12,24H,4H2,1-3H3,(H2,21,22,29)