N-(1,3-benzodioxol-5-yl)-2-(4-methylpyrimidin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-(4-methylpyrimidin-2-yl)sulfanyl-propanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-(4-methylpyrimidin-2-yl)sulfanyl-propanamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[(4-methyl-2-pyrimidinyl)thio]propanamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-(4-methylpyrimidin-2-yl)sulfanylpropanamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[(4-methylpyrimidin-2-yl)thio]propionamide Formula: C15H15N3O3S MolecularWeight: 317.3629

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)SC(C)C(=O)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=NC(=NC=C1)SC(C)C(=O)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C15H15N3O3S/c1-9-5-6-16-15(17-9)22-10(2)14(19)18-11-3-4-12-13(7-11)21-8-20-12/h3-7,10H,8H2,1-2H3,(H,18,19)