N-(1,3-benzodioxol-5-yl)-3-(1-methylimidazol-2-yl)sulfanyl-propanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-3-(1-methylimidazol-2-yl)sulfanyl-propanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-3-(1-methylimidazol-2-yl)sulfanyl-propanamide CAS Name: N-(1,3-benzodioxol-5-yl)-3-[(1-methyl-2-imidazolyl)thio]propanamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-3-(1-methylimidazol-2-yl)sulfanylpropanamide Traditional Name: N-(1,3-benzodioxol-5-yl)-3-[(1-methylimidazol-2-yl)thio]propionamide Formula: C14H15N3O3S MolecularWeight: 305.3522

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCCC(=O)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CN1C=CN=C1SCCC(=O)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C14H15N3O3S/c1-17-6-5-15-14(17)21-7-4-13(18)16-10-2-3-11-12(8-10)20-9-19-11/h2-3,5-6,8H,4,7,9H2,1H3,(H,16,18)