N-(1,3-benzodioxol-5-yl)-2-(4-phenylpyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-(4-phenylpyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-(4-phenylpyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[(4-phenyl-2-pyrimidinyl)thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-(4-phenylpyrimidin-2-yl)sulfanylacetamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[(4-phenylpyrimidin-2-yl)thio]acetamide Formula: C19H15N3O3S MolecularWeight: 365.4057

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)CSC3=NC=CC(=N3)C4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)CSC3=NC=CC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C19H15N3O3S/c23-18(21-14-6-7-16-17(10-14)25-12-24-16)11-26-19-20-9-8-15(22-19)13-4-2-1-3-5-13/h1-10H,11-12H2,(H,21,23)