1-(2,6-diethylphenyl)-3-(4-morpholin-4-ylsulfonylphenyl)thiourea

Systemtic Name: 1-(2,6-diethylphenyl)-3-(4-morpholin-4-ylsulfonylphenyl)thiourea Openeye Name: 1-(2,6-diethylphenyl)-3-(4-morpholinosulfonylphenyl)thiourea CAS Name: 1-(2,6-diethylphenyl)-3-[4-(4-morpholinylsulfonyl)phenyl]thiourea IUPAC Name: 1-(2,6-diethylphenyl)-3-(4-morpholin-4-ylsulfonylphenyl)thiourea Traditional Name: 1-(2,6-diethylphenyl)-3-(4-morpholinosulfonylphenyl)thiourea Formula: C21H27N3O3S2 MolecularWeight: 433.58738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H27N3O3S2/c1-3-16-6-5-7-17(4-2)20(16)23-21(28)22-18-8-10-19(11-9-18)29(25,26)24-12-14-27-15-13-24/h5-11H,3-4,12-15H2,1-2H3,(H2,22,23,28)