2-(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanyl-N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]ethanamide

Systemtic Name: 2-(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanyl-N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]ethanamide Openeye Name: 2-(4-amino-6-methyl-pyrimidin-2-yl)sulfanyl-N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]acetamide CAS Name: 2-[(4-amino-6-methyl-2-pyrimidinyl)thio]-N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]acetamide IUPAC Name: 2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]acetamide Traditional Name: 2-[(4-amino-6-methyl-pyrimidin-2-yl)thio]-N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]acetamide Formula: C16H18N4O3S MolecularWeight: 346.40412

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N4O3S/c1-9-5-14(17)20-16(18-9)24-7-15(21)19-10(2)11-3-4-12-13(6-11)23-8-22-12/h3-6,10H,7-8H2,1-2H3,(H,19,21)(H2,17,18,20)/t10-/m1/s1