1-[(2S)-2-methylheptyl]-3-[(4-methyl-3-sulfamoyl-phenyl)carbonylamino]thiourea

Systemtic Name: 1-[(2S)-2-methylheptyl]-3-[(4-methyl-3-sulfamoyl-phenyl)carbonylamino]thiourea Openeye Name: 1-[(2S)-2-methylheptyl]-3-[(4-methyl-3-sulfamoyl-benzoyl)amino]thiourea CAS Name: 1-[(2S)-2-methylheptyl]-3-[[(4-methyl-3-sulfamoylphenyl)-oxomethyl]amino]thiourea IUPAC Name: 1-[(2S)-2-methylheptyl]-3-[(4-methyl-3-sulfamoylbenzoyl)amino]thiourea Traditional Name: 1-[(2S)-2-methylheptyl]-3-[(4-methyl-3-sulfamoyl-benzoyl)amino]thiourea Formula: C17H28N4O3S2 MolecularWeight: 400.55922

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H28N4O3S2/c1-4-5-6-7-12(2)11-19-17(25)21-20-16(22)14-9-8-13(3)15(10-14)26(18,23)24/h8-10,12H,4-7,11H2,1-3H3,(H,20,22)(H2,18,23,24)(H2,19,21,25)/t12-/m0/s1