N-(6-acetamido-2-butylsulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl)thiophene-2-carboxamide

Systemtic Name: N-(6-acetamido-2-butylsulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl)thiophene-2-carboxamide Openeye Name: N-(6-acetamido-2-butylsulfanyl-4-oxo-1H-pyrimidin-5-yl)thiophene-2-carboxamide CAS Name: N-[6-acetamido-2-(butylthio)-4-oxo-1H-pyrimidin-5-yl]-2-thiophenecarboxamide IUPAC Name: N-(6-acetamido-2-butylsulfanyl-4-oxo-1H-pyrimidin-5-yl)thiophene-2-carboxamide Traditional Name: N-[6-acetamido-2-(butylthio)-4-keto-1H-pyrimidin-5-yl]thiophene-2-carboxamide Formula: C15H18N4O3S2 MolecularWeight: 366.45842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC(=O)C(=C(N1)NC(=O)C)NC(=O)C2=CC=CS2

Isomeric SMILES

CCCCSC1=NC(=O)C(=C(N1)NC(=O)C)NC(=O)C2=CC=CS2

InChI

InChI=1S/C15H18N4O3S2/c1-3-4-7-24-15-18-12(16-9(2)20)11(14(22)19-15)17-13(21)10-6-5-8-23-10/h5-6,8H,3-4,7H2,1-2H3,(H,17,21)(H2,16,18,19,20,22)