N-[3-(imidazol-1-ylmethyl)phenyl]thian-4-amine

Systemtic Name: N-[3-(imidazol-1-ylmethyl)phenyl]thian-4-amine Openeye Name: N-[3-(imidazol-1-ylmethyl)phenyl]tetrahydrothiopyran-4-amine CAS Name: N-[3-(1-imidazolylmethyl)phenyl]-4-thianamine IUPAC Name: N-[3-(imidazol-1-ylmethyl)phenyl]thian-4-amine Traditional Name: [3-(imidazol-1-ylmethyl)phenyl]-tetrahydrothiopyran-4-yl-amine Formula: C15H19N3S MolecularWeight: 273.39646

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCC1NC2=CC=CC(=C2)CN3C=CN=C3

Isomeric SMILES

C1CSCCC1NC2=CC=CC(=C2)CN3C=CN=C3

InChI

InChI=1S/C15H19N3S/c1-2-13(11-18-7-6-16-12-18)10-15(3-1)17-14-4-8-19-9-5-14/h1-3,6-7,10,12,14,17H,4-5,8-9,11H2