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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=C(C(=NO3)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=C(C(=NO3)C)C

InChI

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