1-[3-(dimethylsulfamoyl)phenyl]-3-(propylcarbamothioylamino)thiourea

Systemtic Name: 1-[3-(dimethylsulfamoyl)phenyl]-3-(propylcarbamothioylamino)thiourea Openeye Name: 1-[3-(dimethylsulfamoyl)phenyl]-3-(propylcarbamothioylamino)thiourea CAS Name: 1-[[[3-(dimethylsulfamoyl)anilino]-sulfanylidenemethyl]amino]-3-propylthiourea IUPAC Name: 1-[3-(dimethylsulfamoyl)phenyl]-3-(propylcarbamothioylamino)thiourea Traditional Name: 1-[3-(dimethylsulfamoyl)phenyl]-3-(propylthiocarbamoylamino)thiourea Formula: C13H21N5O2S3 MolecularWeight: 375.53314

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21N5O2S3/c1-4-8-14-12(21)16-17-13(22)15-10-6-5-7-11(9-10)23(19,20)18(2)3/h5-7,9H,4,8H2,1-3H3,(H2,14,16,21)(H2,15,17,22)