1-(2,5-dimethylphenyl)-3-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]thiourea

Systemtic Name: 1-(2,5-dimethylphenyl)-3-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]thiourea Openeye Name: 1-(2,5-dimethylphenyl)-3-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]thiourea CAS Name: 1-(2,5-dimethylphenyl)-3-[4-[(6-methoxy-4-pyrimidinyl)sulfamoyl]phenyl]thiourea IUPAC Name: 1-(2,5-dimethylphenyl)-3-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]thiourea Traditional Name: 1-(2,5-dimethylphenyl)-3-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]thiourea Formula: C20H21N5O3S2 MolecularWeight: 443.54244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC(=NC=N3)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC(=NC=N3)OC

InChI

InChI=1S/C20H21N5O3S2/c1-13-4-5-14(2)17(10-13)24-20(29)23-15-6-8-16(9-7-15)30(26,27)25-18-11-19(28-3)22-12-21-18/h4-12H,1-3H3,(H,21,22,25)(H2,23,24,29)