1-[[3-(dimethylsulfamoyl)phenyl]carbonylamino]-3-[(2R)-2-methylheptyl]thiourea

Systemtic Name: 1-[[3-(dimethylsulfamoyl)phenyl]carbonylamino]-3-[(2R)-2-methylheptyl]thiourea Openeye Name: 1-[[3-(dimethylsulfamoyl)benzoyl]amino]-3-[(2R)-2-methylheptyl]thiourea CAS Name: 1-[[[3-(dimethylsulfamoyl)phenyl]-oxomethyl]amino]-3-[(2R)-2-methylheptyl]thiourea IUPAC Name: 1-[[3-(dimethylsulfamoyl)benzoyl]amino]-3-[(2R)-2-methylheptyl]thiourea Traditional Name: 1-[[3-(dimethylsulfamoyl)benzoyl]amino]-3-[(2R)-2-methylheptyl]thiourea Formula: C18H30N4O3S2 MolecularWeight: 414.5858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)CNC(=S)NNC(=O)C1=CC(=CC=C1)S(=O)(=O)N(C)C

Isomeric SMILES

CCCCC[C@@H](C)CNC(=S)NNC(=O)C1=CC(=CC=C1)S(=O)(=O)N(C)C

InChI

InChI=1S/C18H30N4O3S2/c1-5-6-7-9-14(2)13-19-18(26)21-20-17(23)15-10-8-11-16(12-15)27(24,25)22(3)4/h8,10-12,14H,5-7,9,13H2,1-4H3,(H,20,23)(H2,19,21,26)/t14-/m1/s1