6-(dimethylamino)-5-nitro-N,N-bis(propylsulfanyl)pyrimidine-4-carbothioamide

Systemtic Name: 6-(dimethylamino)-5-nitro-N,N-bis(propylsulfanyl)pyrimidine-4-carbothioamide Openeye Name: 6-(dimethylamino)-5-nitro-N,N-bis(propylsulfanyl)pyrimidine-4-carbothioamide CAS Name: 6-(dimethylamino)-5-nitro-N,N-bis(propylthio)-4-pyrimidinecarbothioamide IUPAC Name: 6-(dimethylamino)-5-nitro-N,N-bis(propylsulfanyl)pyrimidine-4-carbothioamide Traditional Name: 6-(dimethylamino)-5-nitro-N,N-bis(propylthio)pyrimidine-4-carbothioamide Formula: C13H21N5O2S3 MolecularWeight: 375.53314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCSN(C(=S)C1=C(C(=NC=N1)N(C)C)[N+](=O)[O-])SCCC

Isomeric SMILES

CCCSN(C(=S)C1=C(C(=NC=N1)N(C)C)[N+](=O)[O-])SCCC

InChI

InChI=1S/C13H21N5O2S3/c1-5-7-22-18(23-8-6-2)13(21)10-11(17(19)20)12(16(3)4)15-9-14-10/h9H,5-8H2,1-4H3