N-butyl-3-(2-methylsulfanylpyrimidin-5-yl)prop-2-enamide

Systemtic Name: N-butyl-3-(2-methylsulfanylpyrimidin-5-yl)prop-2-enamide Openeye Name: N-butyl-3-(2-methylsulfanylpyrimidin-5-yl)prop-2-enamide CAS Name: N-butyl-3-[2-(methylthio)-5-pyrimidinyl]-2-propenamide IUPAC Name: N-butyl-3-(2-methylsulfanylpyrimidin-5-yl)prop-2-enamide Traditional Name: N-butyl-3-[2-(methylthio)pyrimidin-5-yl]acrylamide Formula: C12H17N3OS MolecularWeight: 251.34788

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C=CC1=CN=C(N=C1)SC

Isomeric SMILES

CCCCNC(=O)C=CC1=CN=C(N=C1)SC

InChI

InChI=1S/C12H17N3OS/c1-3-4-7-13-11(16)6-5-10-8-14-12(17-2)15-9-10/h5-6,8-9H,3-4,7H2,1-2H3,(H,13,16)