1-[2-(3,4-diethoxyphenyl)ethanoylamino]-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea

Systemtic Name: 1-[2-(3,4-diethoxyphenyl)ethanoylamino]-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea Openeye Name: 1-[[2-(3,4-diethoxyphenyl)acetyl]amino]-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea CAS Name: 1-[[2-(3,4-diethoxyphenyl)-1-oxoethyl]amino]-3-[4-(2-pyrimidinylsulfamoyl)phenyl]thiourea IUPAC Name: 1-[[2-(3,4-diethoxyphenyl)acetyl]amino]-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea Traditional Name: 1-[[2-(3,4-diethoxyphenyl)acetyl]amino]-3-[4-(2-pyrimidylsulfamoyl)phenyl]thiourea Formula: C23H26N6O5S2 MolecularWeight: 530.61974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26N6O5S2/c1-3-33-19-11-6-16(14-20(19)34-4-2)15-21(30)27-28-23(35)26-17-7-9-18(10-8-17)36(31,32)29-22-24-12-5-13-25-22/h5-14H,3-4,15H2,1-2H3,(H,27,30)(H,24,25,29)(H2,26,28,35)