1-(4-butylphenyl)-3-[[2-(thiophen-2-ylsulfonylamino)phenyl]carbonylamino]thiourea

Systemtic Name: 1-(4-butylphenyl)-3-[[2-(thiophen-2-ylsulfonylamino)phenyl]carbonylamino]thiourea Openeye Name: 1-(4-butylphenyl)-3-[[2-(2-thienylsulfonylamino)benzoyl]amino]thiourea CAS Name: 1-(4-butylphenyl)-3-[[oxo-[2-(thiophen-2-ylsulfonylamino)phenyl]methyl]amino]thiourea IUPAC Name: 1-(4-butylphenyl)-3-[[2-(thiophen-2-ylsulfonylamino)benzoyl]amino]thiourea Traditional Name: 1-(4-butylphenyl)-3-[[2-(2-thienylsulfonylamino)benzoyl]amino]thiourea Formula: C22H24N4O3S3 MolecularWeight: 488.64596

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)C2=CC=CC=C2NS(=O)(=O)C3=CC=CS3

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)C2=CC=CC=C2NS(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C22H24N4O3S3/c1-2-3-7-16-11-13-17(14-12-16)23-22(30)25-24-21(27)18-8-4-5-9-19(18)26-32(28,29)20-10-6-15-31-20/h4-6,8-15,26H,2-3,7H2,1H3,(H,24,27)(H2,23,25,30)