N-[2-(1,2,3-triazol-1-yl)phenyl]thian-4-amine

Systemtic Name: N-[2-(1,2,3-triazol-1-yl)phenyl]thian-4-amine Openeye Name: N-[2-(triazol-1-yl)phenyl]tetrahydrothiopyran-4-amine CAS Name: N-[2-(1-triazolyl)phenyl]-4-thianamine IUPAC Name: N-[2-(triazol-1-yl)phenyl]thian-4-amine Traditional Name: tetrahydrothiopyran-4-yl-[2-(triazol-1-yl)phenyl]amine Formula: C13H16N4S MolecularWeight: 260.35794

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCC1NC2=CC=CC=C2N3C=CN=N3

Isomeric SMILES

C1CSCCC1NC2=CC=CC=C2N3C=CN=N3

InChI

InChI=1S/C13H16N4S/c1-2-4-13(17-8-7-14-16-17)12(3-1)15-11-5-9-18-10-6-11/h1-4,7-8,11,15H,5-6,9-10H2