1-(4-butan-2-ylphenyl)-3-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]thiourea

Systemtic Name: 1-(4-butan-2-ylphenyl)-3-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]thiourea Openeye Name: 1-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]-3-(4-sec-butylphenyl)thiourea CAS Name: 1-(4-butan-2-ylphenyl)-3-[4-[(6-methoxy-4-pyrimidinyl)sulfamoyl]phenyl]thiourea IUPAC Name: 1-(4-butan-2-ylphenyl)-3-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]thiourea Traditional Name: 1-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]-3-(4-sec-butylphenyl)thiourea Formula: C22H25N5O3S2 MolecularWeight: 471.5956

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N5O3S2/c1-4-15(2)16-5-7-17(8-6-16)25-22(31)26-18-9-11-19(12-10-18)32(28,29)27-20-13-21(30-3)24-14-23-20/h5-15H,4H2,1-3H3,(H,23,24,27)(H2,25,26,31)