2-[(4-phenyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamine

Systemtic Name: 2-[(4-phenyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamine Openeye Name: 2-[(5-isopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamine CAS Name: 2-[(4-phenyl-5-propan-2-yl-1,2,4-triazol-3-yl)thio]ethanamine IUPAC Name: 2-[(4-phenyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamine Traditional Name: 2-[(5-isopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]ethylamine Formula: C13H18N4S MolecularWeight: 262.37382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(N1C2=CC=CC=C2)SCCN

Isomeric SMILES

CC(C)C1=NN=C(N1C2=CC=CC=C2)SCCN

InChI

InChI=1S/C13H18N4S/c1-10(2)12-15-16-13(18-9-8-14)17(12)11-6-4-3-5-7-11/h3-7,10H,8-9,14H2,1-2H3