N-(4-pyrazol-1-ylphenyl)thian-4-amine

Systemtic Name: N-(4-pyrazol-1-ylphenyl)thian-4-amine Openeye Name: N-(4-pyrazol-1-ylphenyl)tetrahydrothiopyran-4-amine CAS Name: N-[4-(1-pyrazolyl)phenyl]-4-thianamine IUPAC Name: N-(4-pyrazol-1-ylphenyl)thian-4-amine Traditional Name: (4-pyrazol-1-ylphenyl)-tetrahydrothiopyran-4-yl-amine Formula: C14H17N3S MolecularWeight: 259.36988

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17N3S/c1-8-15-17(9-1)14-4-2-12(3-5-14)16-13-6-10-18-11-7-13/h1-5,8-9,13,16H,6-7,10-11H2