(2R)-2-(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanyl-N-(1,3-benzodioxol-5-yl)propanamide

Systemtic Name: (2R)-2-(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanyl-N-(1,3-benzodioxol-5-yl)propanamide Openeye Name: (2R)-2-(4-amino-6-methyl-pyrimidin-2-yl)sulfanyl-N-(1,3-benzodioxol-5-yl)propanamide CAS Name: (2R)-2-[(4-amino-6-methyl-2-pyrimidinyl)thio]-N-(1,3-benzodioxol-5-yl)propanamide IUPAC Name: (2R)-2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-N-(1,3-benzodioxol-5-yl)propanamide Traditional Name: (2R)-2-[(4-amino-6-methyl-pyrimidin-2-yl)thio]-N-(1,3-benzodioxol-5-yl)propionamide Formula: C15H16N4O3S MolecularWeight: 332.37754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC(C)C(=O)NC2=CC3=C(C=C2)OCO3)N

Isomeric SMILES

CC1=CC(=NC(=N1)S[C@H](C)C(=O)NC2=CC3=C(C=C2)OCO3)N

InChI

InChI=1S/C15H16N4O3S/c1-8-5-13(16)19-15(17-8)23-9(2)14(20)18-10-3-4-11-12(6-10)22-7-21-11/h3-6,9H,7H2,1-2H3,(H,18,20)(H2,16,17,19)/t9-/m1/s1