3-(5-methylsulfanyl-4-propan-2-yl-1,2,4-triazol-3-yl)propan-1-amine

Systemtic Name: 3-(5-methylsulfanyl-4-propan-2-yl-1,2,4-triazol-3-yl)propan-1-amine Openeye Name: 3-(4-isopropyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propan-1-amine CAS Name: 3-[5-(methylthio)-4-propan-2-yl-1,2,4-triazol-3-yl]-1-propanamine IUPAC Name: 3-(5-methylsulfanyl-4-propan-2-yl-1,2,4-triazol-3-yl)propan-1-amine Traditional Name: 3-[4-isopropyl-5-(methylthio)-1,2,4-triazol-3-yl]propylamine Formula: C9H18N4S MolecularWeight: 214.33102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=NN=C1SC)CCCN

Isomeric SMILES

CC(C)N1C(=NN=C1SC)CCCN

InChI

InChI=1S/C9H18N4S/c1-7(2)13-8(5-4-6-10)11-12-9(13)14-3/h7H,4-6,10H2,1-3H3