1-(3,3-dimethyl-1-pyrazol-1-yl-butan-2-yl)-3-(4-sulfamoylphenyl)thiourea

Systemtic Name: 1-(3,3-dimethyl-1-pyrazol-1-yl-butan-2-yl)-3-(4-sulfamoylphenyl)thiourea Openeye Name: 1-[2,2-dimethyl-1-(pyrazol-1-ylmethyl)propyl]-3-(4-sulfamoylphenyl)thiourea CAS Name: 1-[3,3-dimethyl-1-(1-pyrazolyl)butan-2-yl]-3-(4-sulfamoylphenyl)thiourea IUPAC Name: 1-(3,3-dimethyl-1-pyrazol-1-ylbutan-2-yl)-3-(4-sulfamoylphenyl)thiourea Traditional Name: 1-[2,2-dimethyl-1-(pyrazol-1-ylmethyl)propyl]-3-(4-sulfamoylphenyl)thiourea Formula: C16H23N5O2S2 MolecularWeight: 381.51612

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(CN1C=CC=N1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

CC(C)(C)C(CN1C=CC=N1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C16H23N5O2S2/c1-16(2,3)14(11-21-10-4-9-18-21)20-15(24)19-12-5-7-13(8-6-12)25(17,22)23/h4-10,14H,11H2,1-3H3,(H2,17,22,23)(H2,19,20,24)