N-[6-azanyl-2-[2-(naphthalen-1-ylamino)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl]furan-2-carboxamide

Systemtic Name: N-[6-azanyl-2-[2-(naphthalen-1-ylamino)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl]furan-2-carboxamide Openeye Name: N-[6-amino-2-[2-(1-naphthylamino)-2-oxo-ethyl]sulfanyl-4-oxo-1H-pyrimidin-5-yl]furan-2-carboxamide CAS Name: N-[6-amino-2-[[2-(1-naphthalenylamino)-2-oxoethyl]thio]-4-oxo-1H-pyrimidin-5-yl]-2-furancarboxamide IUPAC Name: N-[6-amino-2-[2-(naphthalen-1-ylamino)-2-oxoethyl]sulfanyl-4-oxo-1H-pyrimidin-5-yl]furan-2-carboxamide Traditional Name: N-[6-amino-4-keto-2-[[2-keto-2-(1-naphthylamino)ethyl]thio]-1H-pyrimidin-5-yl]-2-furamide Formula: C21H17N5O4S MolecularWeight: 435.45578

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2NC(=O)CSC3=NC(=O)C(=C(N3)N)NC(=O)C4=CC=CO4

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2NC(=O)CSC3=NC(=O)C(=C(N3)N)NC(=O)C4=CC=CO4

InChI

InChI=1S/C21H17N5O4S/c22-18-17(24-19(28)15-9-4-10-30-15)20(29)26-21(25-18)31-11-16(27)23-14-8-3-6-12-5-1-2-7-13(12)14/h1-10H,11H2,(H,23,27)(H,24,28)(H3,22,25,26,29)