N-(4-butylphenyl)-2-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(4-butylphenyl)-2-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanamide Openeye Name: N-(4-butylphenyl)-2-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetamide CAS Name: N-(4-butylphenyl)-2-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)thio]acetamide IUPAC Name: N-(4-butylphenyl)-2-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetamide Traditional Name: N-(4-butylphenyl)-2-[(4-keto-6-methyl-1H-pyrimidin-2-yl)thio]acetamide Formula: C17H21N3O2S MolecularWeight: 331.43254

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)CSC2=NC(=O)C=C(N2)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)CSC2=NC(=O)C=C(N2)C

InChI

InChI=1S/C17H21N3O2S/c1-3-4-5-13-6-8-14(9-7-13)19-16(22)11-23-17-18-12(2)10-15(21)20-17/h6-10H,3-5,11H2,1-2H3,(H,19,22)(H,18,20,21)