1-(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)-3-[3-(dimethylamino)-2,2-dimethyl-propyl]thiourea

Systemtic Name: 1-(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)-3-[3-(dimethylamino)-2,2-dimethyl-propyl]thiourea Openeye Name: 1-(2-chloro-5-morpholinosulfonyl-phenyl)-3-[3-(dimethylamino)-2,2-dimethyl-propyl]thiourea CAS Name: 1-[2-chloro-5-(4-morpholinylsulfonyl)phenyl]-3-[3-(dimethylamino)-2,2-dimethylpropyl]thiourea IUPAC Name: 1-(2-chloro-5-morpholin-4-ylsulfonylphenyl)-3-[3-(dimethylamino)-2,2-dimethylpropyl]thiourea Traditional Name: 1-(2-chloro-5-morpholinosulfonyl-phenyl)-3-[3-(dimethylamino)-2,2-dimethyl-propyl]thiourea Formula: C18H29ClN4O3S2 MolecularWeight: 449.03086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=S)NC1=C(C=CC(=C1)S(=O)(=O)N2CCOCC2)Cl)CN(C)C

Isomeric SMILES

CC(C)(CNC(=S)NC1=C(C=CC(=C1)S(=O)(=O)N2CCOCC2)Cl)CN(C)C

InChI

InChI=1S/C18H29ClN4O3S2/c1-18(2,13-22(3)4)12-20-17(27)21-16-11-14(5-6-15(16)19)28(24,25)23-7-9-26-10-8-23/h5-6,11H,7-10,12-13H2,1-4H3,(H2,20,21,27)