1-(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)-3-propyl-thiourea

Systemtic Name: 1-(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)-3-propyl-thiourea Openeye Name: 1-(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)-3-propyl-thiourea CAS Name: 1-[3-(methylthio)-1H-1,2,4-triazol-5-yl]-3-propylthiourea IUPAC Name: 1-(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)-3-propylthiourea Traditional Name: 1-[3-(methylthio)-1H-1,2,4-triazol-5-yl]-3-propyl-thiourea Formula: C7H13N5S2 MolecularWeight: 231.34162

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=S)NC1=NC(=NN1)SC

Isomeric SMILES

CCCNC(=S)NC1=NC(=NN1)SC

InChI

InChI=1S/C7H13N5S2/c1-3-4-8-6(13)9-5-10-7(14-2)12-11-5/h3-4H2,1-2H3,(H3,8,9,10,11,12,13)