1-(2,6-diethylphenyl)-3-(2-methoxy-5-morpholin-4-ylsulfonyl-phenyl)thiourea

Systemtic Name: 1-(2,6-diethylphenyl)-3-(2-methoxy-5-morpholin-4-ylsulfonyl-phenyl)thiourea Openeye Name: 1-(2,6-diethylphenyl)-3-(2-methoxy-5-morpholinosulfonyl-phenyl)thiourea CAS Name: 1-(2,6-diethylphenyl)-3-[2-methoxy-5-(4-morpholinylsulfonyl)phenyl]thiourea IUPAC Name: 1-(2,6-diethylphenyl)-3-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)thiourea Traditional Name: 1-(2,6-diethylphenyl)-3-(2-methoxy-5-morpholinosulfonyl-phenyl)thiourea Formula: C22H29N3O4S2 MolecularWeight: 463.61336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29N3O4S2/c1-4-16-7-6-8-17(5-2)21(16)24-22(30)23-19-15-18(9-10-20(19)28-3)31(26,27)25-11-13-29-14-12-25/h6-10,15H,4-5,11-14H2,1-3H3,(H2,23,24,30)