3-(imidazol-1-ylmethyl)-2,3-dihydrothiochromen-4-one

Systemtic Name: 3-(imidazol-1-ylmethyl)-2,3-dihydrothiochromen-4-one Openeye Name: 3-(imidazol-1-ylmethyl)thiochroman-4-one CAS Name: 3-(1-imidazolylmethyl)-2,3-dihydro-1-benzothiopyran-4-one IUPAC Name: 3-(imidazol-1-ylmethyl)-2,3-dihydrothiochromen-4-one Traditional Name: 3-(imidazol-1-ylmethyl)thiochroman-4-one Formula: C13H12N2OS MolecularWeight: 244.31218

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)C2=CC=CC=C2S1)CN3C=CN=C3

Isomeric SMILES

C1C(C(=O)C2=CC=CC=C2S1)CN3C=CN=C3

InChI

InChI=1S/C13H12N2OS/c16-13-10(7-15-6-5-14-9-15)8-17-12-4-2-1-3-11(12)13/h1-6,9-10H,7-8H2