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

Systemtic Name: 3-(1H-imidazol-2-ylmethyl)-2,3-dihydrothiochromen-4-one Openeye Name: 3-(1H-imidazol-2-ylmethyl)thiochroman-4-one CAS Name: 3-(1H-imidazol-2-ylmethyl)-2,3-dihydro-1-benzothiopyran-4-one IUPAC Name: 3-(1H-imidazol-2-ylmethyl)-2,3-dihydrothiochromen-4-one Traditional Name: 3-(1H-imidazol-2-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)CC3=NC=CN3

Isomeric SMILES

C1C(C(=O)C2=CC=CC=C2S1)CC3=NC=CN3

InChI

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