3-[1-(phenylmethyl)imidazol-2-yl]sulfanylpropanamide

Systemtic Name: 3-[1-(phenylmethyl)imidazol-2-yl]sulfanylpropanamide Openeye Name: 3-(1-benzylimidazol-2-yl)sulfanylpropanamide CAS Name: 3-[[1-(phenylmethyl)-2-imidazolyl]thio]propanamide IUPAC Name: 3-(1-benzylimidazol-2-yl)sulfanylpropanamide Traditional Name: 3-[(1-benzylimidazol-2-yl)thio]propionamide Formula: C13H15N3OS MolecularWeight: 261.3427

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=CN=C2SCCC(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CN2C=CN=C2SCCC(=O)N

InChI

InChI=1S/C13H15N3OS/c14-12(17)6-9-18-13-15-7-8-16(13)10-11-4-2-1-3-5-11/h1-5,7-8H,6,9-10H2,(H2,14,17)