1-(3-methylbutyl)-3-(4-sulfamoylphenyl)thiourea

Systemtic Name: 1-(3-methylbutyl)-3-(4-sulfamoylphenyl)thiourea Openeye Name: 1-isopentyl-3-(4-sulfamoylphenyl)thiourea CAS Name: 1-(3-methylbutyl)-3-(4-sulfamoylphenyl)thiourea IUPAC Name: 1-(3-methylbutyl)-3-(4-sulfamoylphenyl)thiourea Traditional Name: 1-isoamyl-3-(4-sulfamoylphenyl)thiourea Formula: C12H19N3O2S2 MolecularWeight: 301.42816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=S)NC1=CC=C(C=C1)S(=O)(=O)N

Isomeric SMILES

CC(C)CCNC(=S)NC1=CC=C(C=C1)S(=O)(=O)N

InChI

InChI=1S/C12H19N3O2S2/c1-9(2)7-8-14-12(18)15-10-3-5-11(6-4-10)19(13,16)17/h3-6,9H,7-8H2,1-2H3,(H2,13,16,17)(H2,14,15,18)