1-methyl-3-[4-(1H-1,2,4-triazol-5-yl)butyl]thiourea

Systemtic Name: 1-methyl-3-[4-(1H-1,2,4-triazol-5-yl)butyl]thiourea Openeye Name: 1-methyl-3-[4-(1H-1,2,4-triazol-5-yl)butyl]thiourea CAS Name: 1-methyl-3-[4-(1H-1,2,4-triazol-5-yl)butyl]thiourea IUPAC Name: 1-methyl-3-[4-(1H-1,2,4-triazol-5-yl)butyl]thiourea Traditional Name: 1-methyl-3-[4-(1H-1,2,4-triazol-5-yl)butyl]thiourea Formula: C8H15N5S MolecularWeight: 213.3032

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NCCCCC1=NC=NN1

Isomeric SMILES

CNC(=S)NCCCCC1=NC=NN1

InChI

InChI=1S/C8H15N5S/c1-9-8(14)10-5-3-2-4-7-11-6-12-13-7/h6H,2-5H2,1H3,(H2,9,10,14)(H,11,12,13)