1-[3-(dimethylsulfamoyl)phenyl]-3-(prop-2-enylcarbamothioylamino)thiourea

Systemtic Name: 1-[3-(dimethylsulfamoyl)phenyl]-3-(prop-2-enylcarbamothioylamino)thiourea Openeye Name: 1-allyl-3-[[3-(dimethylsulfamoyl)phenyl]carbamothioylamino]thiourea CAS Name: 1-[[[3-(dimethylsulfamoyl)anilino]-sulfanylidenemethyl]amino]-3-prop-2-enylthiourea IUPAC Name: 1-[3-(dimethylsulfamoyl)phenyl]-3-(prop-2-enylcarbamothioylamino)thiourea Traditional Name: 1-allyl-3-[[3-(dimethylsulfamoyl)phenyl]thiocarbamoylamino]thiourea Formula: C13H19N5O2S3 MolecularWeight: 373.51726

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC(=C1)NC(=S)NNC(=S)NCC=C

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC(=C1)NC(=S)NNC(=S)NCC=C

InChI

InChI=1S/C13H19N5O2S3/c1-4-8-14-12(21)16-17-13(22)15-10-6-5-7-11(9-10)23(19,20)18(2)3/h4-7,9H,1,8H2,2-3H3,(H2,14,16,21)(H2,15,17,22)