3-[phenyl(pyridin-4-ylmethyl)amino]propanethioamide

Systemtic Name: 3-[phenyl(pyridin-4-ylmethyl)amino]propanethioamide Openeye Name: 3-[N-(4-pyridylmethyl)anilino]propanethioamide CAS Name: 3-[N-(pyridin-4-ylmethyl)anilino]propanethioamide IUPAC Name: 3-[N-(pyridin-4-ylmethyl)anilino]propanethioamide Traditional Name: 3-[N-(4-pyridylmethyl)anilino]thiopropionamide Formula: C15H17N3S MolecularWeight: 271.38058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CCC(=S)N)CC2=CC=NC=C2

Isomeric SMILES

C1=CC=C(C=C1)N(CCC(=S)N)CC2=CC=NC=C2

InChI

InChI=1S/C15H17N3S/c16-15(19)8-11-18(14-4-2-1-3-5-14)12-13-6-9-17-10-7-13/h1-7,9-10H,8,11-12H2,(H2,16,19)