1-butyl-3-[[3-(dimethylsulfamoyl)phenyl]carbamothioylamino]thiourea

Systemtic Name: 1-butyl-3-[[3-(dimethylsulfamoyl)phenyl]carbamothioylamino]thiourea Openeye Name: 1-butyl-3-[[3-(dimethylsulfamoyl)phenyl]carbamothioylamino]thiourea CAS Name: 1-butyl-3-[[[3-(dimethylsulfamoyl)anilino]-sulfanylidenemethyl]amino]thiourea IUPAC Name: 1-butyl-3-[[3-(dimethylsulfamoyl)phenyl]carbamothioylamino]thiourea Traditional Name: 1-butyl-3-[[3-(dimethylsulfamoyl)phenyl]thiocarbamoylamino]thiourea Formula: C14H23N5O2S3 MolecularWeight: 389.55972

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NNC(=S)NC1=CC(=CC=C1)S(=O)(=O)N(C)C

Isomeric SMILES

CCCCNC(=S)NNC(=S)NC1=CC(=CC=C1)S(=O)(=O)N(C)C

InChI

InChI=1S/C14H23N5O2S3/c1-4-5-9-15-13(22)17-18-14(23)16-11-7-6-8-12(10-11)24(20,21)19(2)3/h6-8,10H,4-5,9H2,1-3H3,(H2,15,17,22)(H2,16,18,23)