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

Systemtic Name: N-[3-(pyrrolidin-1-ylmethyl)phenyl]thian-4-amine Openeye Name: N-[3-(pyrrolidin-1-ylmethyl)phenyl]tetrahydrothiopyran-4-amine CAS Name: N-[3-(1-pyrrolidinylmethyl)phenyl]-4-thianamine IUPAC Name: N-[3-(pyrrolidin-1-ylmethyl)phenyl]thian-4-amine Traditional Name: [3-(pyrrolidinomethyl)phenyl]-tetrahydrothiopyran-4-yl-amine Formula: C16H24N2S MolecularWeight: 276.44016

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC(=CC=C2)NC3CCSCC3

Isomeric SMILES

C1CCN(C1)CC2=CC(=CC=C2)NC3CCSCC3

InChI

InChI=1S/C16H24N2S/c1-2-9-18(8-1)13-14-4-3-5-16(12-14)17-15-6-10-19-11-7-15/h3-5,12,15,17H,1-2,6-11,13H2