N-(3-pyrazol-1-ylphenyl)thian-4-amine

Systemtic Name: N-(3-pyrazol-1-ylphenyl)thian-4-amine Openeye Name: N-(3-pyrazol-1-ylphenyl)tetrahydrothiopyran-4-amine CAS Name: N-[3-(1-pyrazolyl)phenyl]-4-thianamine IUPAC Name: N-(3-pyrazol-1-ylphenyl)thian-4-amine Traditional Name: (3-pyrazol-1-ylphenyl)-tetrahydrothiopyran-4-yl-amine Formula: C14H17N3S MolecularWeight: 259.36988

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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