1-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]-3-(4-ethoxyphenyl)thiourea

Systemtic Name: 1-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]-3-(4-ethoxyphenyl)thiourea Openeye Name: 1-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]-3-(4-ethoxyphenyl)thiourea CAS Name: 1-[4-[(2,6-dimethoxy-4-pyrimidinyl)sulfamoyl]phenyl]-3-(4-ethoxyphenyl)thiourea IUPAC Name: 1-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]-3-(4-ethoxyphenyl)thiourea Traditional Name: 1-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]-3-p-phenetyl-thiourea Formula: C21H23N5O5S2 MolecularWeight: 489.56782

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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=CC(=NC(=N3)OC)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC(=NC(=N3)OC)OC

InChI

InChI=1S/C21H23N5O5S2/c1-4-31-16-9-5-14(6-10-16)22-21(32)23-15-7-11-17(12-8-15)33(27,28)26-18-13-19(29-2)25-20(24-18)30-3/h5-13H,4H2,1-3H3,(H2,22,23,32)(H,24,25,26)