N-[4-(4-methylphenyl)-2-sulfanylidene-pyrimidin-1-yl]butanamide

Systemtic Name: N-[4-(4-methylphenyl)-2-sulfanylidene-pyrimidin-1-yl]butanamide Openeye Name: N-[4-(p-tolyl)-2-thioxo-pyrimidin-1-yl]butanamide CAS Name: N-[4-(4-methylphenyl)-2-sulfanylidene-1-pyrimidinyl]butanamide IUPAC Name: N-[4-(4-methylphenyl)-2-sulfanylidenepyrimidin-1-yl]butanamide Traditional Name: N-[4-(p-tolyl)-2-thioxo-pyrimidin-1-yl]butyramide Formula: C15H17N3OS MolecularWeight: 287.37998

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NN1C=CC(=NC1=S)C2=CC=C(C=C2)C

Isomeric SMILES

CCCC(=O)NN1C=CC(=NC1=S)C2=CC=C(C=C2)C

InChI

InChI=1S/C15H17N3OS/c1-3-4-14(19)17-18-10-9-13(16-15(18)20)12-7-5-11(2)6-8-12/h5-10H,3-4H2,1-2H3,(H,17,19)