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

Systemtic Name: N-[3-(1,2,3,4-tetrazol-1-yl)phenyl]thian-4-amine Openeye Name: N-[3-(tetrazol-1-yl)phenyl]tetrahydrothiopyran-4-amine CAS Name: N-[3-(1-tetrazolyl)phenyl]-4-thianamine IUPAC Name: N-[3-(tetrazol-1-yl)phenyl]thian-4-amine Traditional Name: tetrahydrothiopyran-4-yl-[3-(tetrazol-1-yl)phenyl]amine Formula: C12H15N5S MolecularWeight: 261.346

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCC1NC2=CC=CC(=C2)N3C=NN=N3

Isomeric SMILES

C1CSCCC1NC2=CC=CC(=C2)N3C=NN=N3

InChI

InChI=1S/C12H15N5S/c1-2-11(14-10-4-6-18-7-5-10)8-12(3-1)17-9-13-15-16-17/h1-3,8-10,14H,4-7H2