(5-propyl-2-sulfanylidene-1,3-dihydroimidazol-4-yl)-pyridin-4-yl-methanone

Systemtic Name: (5-propyl-2-sulfanylidene-1,3-dihydroimidazol-4-yl)-pyridin-4-yl-methanone Openeye Name: (5-propyl-2-thioxo-1,3-dihydroimidazol-4-yl)-(4-pyridyl)methanone CAS Name: (5-propyl-2-sulfanylidene-1,3-dihydroimidazol-4-yl)-pyridin-4-ylmethanone IUPAC Name: (5-propyl-2-sulfanylidene-1,3-dihydroimidazol-4-yl)-pyridin-4-ylmethanone Traditional Name: (5-propyl-2-thioxo-4-imidazolin-4-yl)-(4-pyridyl)methanone Formula: C12H13N3OS MolecularWeight: 247.31612

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(NC(=S)N1)C(=O)C2=CC=NC=C2

Isomeric SMILES

CCCC1=C(NC(=S)N1)C(=O)C2=CC=NC=C2

InChI

InChI=1S/C12H13N3OS/c1-2-3-9-10(15-12(17)14-9)11(16)8-4-6-13-7-5-8/h4-7H,2-3H2,1H3,(H2,14,15,17)