N-[4-oxidanylidene-2-(pyridin-2-ylmethylsulfanyl)-5-(thiophen-2-ylcarbonylamino)-1H-pyrimidin-6-yl]furan-2-carboxamide

Systemtic Name: N-[4-oxidanylidene-2-(pyridin-2-ylmethylsulfanyl)-5-(thiophen-2-ylcarbonylamino)-1H-pyrimidin-6-yl]furan-2-carboxamide Openeye Name: N-[4-oxo-2-(2-pyridylmethylsulfanyl)-5-(thiophene-2-carbonylamino)-1H-pyrimidin-6-yl]furan-2-carboxamide CAS Name: N-[4-oxo-5-[[oxo(thiophen-2-yl)methyl]amino]-2-(2-pyridinylmethylthio)-1H-pyrimidin-6-yl]-2-furancarboxamide IUPAC Name: N-[4-oxo-2-(pyridin-2-ylmethylsulfanyl)-5-(thiophene-2-carbonylamino)-1H-pyrimidin-6-yl]furan-2-carboxamide Traditional Name: N-[4-keto-2-(2-pyridylmethylthio)-5-(2-thenoylamino)-1H-pyrimidin-6-yl]-2-furamide Formula: C20H15N5O4S2 MolecularWeight: 453.4942

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CSC2=NC(=O)C(=C(N2)NC(=O)C3=CC=CO3)NC(=O)C4=CC=CS4

Isomeric SMILES

C1=CC=NC(=C1)CSC2=NC(=O)C(=C(N2)NC(=O)C3=CC=CO3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C20H15N5O4S2/c26-17(13-6-3-9-29-13)23-16-15(22-18(27)14-7-4-10-30-14)19(28)25-20(24-16)31-11-12-5-1-2-8-21-12/h1-10H,11H2,(H,22,27)(H2,23,24,25,26,28)