3-[(4-chloranyl-6-methyl-pyrimidin-2-yl)amino]-2-propylsulfonyl-prop-2-enenitrile

Systemtic Name: 3-[(4-chloranyl-6-methyl-pyrimidin-2-yl)amino]-2-propylsulfonyl-prop-2-enenitrile Openeye Name: 3-[(4-chloro-6-methyl-pyrimidin-2-yl)amino]-2-propylsulfonyl-prop-2-enenitrile CAS Name: 3-[(4-chloro-6-methyl-2-pyrimidinyl)amino]-2-propylsulfonyl-2-propenenitrile IUPAC Name: 3-[(4-chloro-6-methylpyrimidin-2-yl)amino]-2-propylsulfonylprop-2-enenitrile Traditional Name: 3-[(4-chloro-6-methyl-pyrimidin-2-yl)amino]-2-propylsulfonyl-acrylonitrile Formula: C11H13ClN4O2S MolecularWeight: 300.76452

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)C(=CNC1=NC(=CC(=N1)Cl)C)C#N

Isomeric SMILES

CCCS(=O)(=O)C(=CNC1=NC(=CC(=N1)Cl)C)C#N

InChI

InChI=1S/C11H13ClN4O2S/c1-3-4-19(17,18)9(6-13)7-14-11-15-8(2)5-10(12)16-11/h5,7H,3-4H2,1-2H3,(H,14,15,16)