N-[4-[1,3,7-trimethyl-2,6-bis(oxidanylidene)purin-8-yl]sulfanylphenyl]furan-2-carboxamide

Systemtic Name: N-[4-[1,3,7-trimethyl-2,6-bis(oxidanylidene)purin-8-yl]sulfanylphenyl]furan-2-carboxamide Openeye Name: N-[4-(1,3,7-trimethyl-2,6-dioxo-purin-8-yl)sulfanylphenyl]furan-2-carboxamide CAS Name: N-[4-[(1,3,7-trimethyl-2,6-dioxo-8-purinyl)thio]phenyl]-2-furancarboxamide IUPAC Name: N-[4-(1,3,7-trimethyl-2,6-dioxopurin-8-yl)sulfanylphenyl]furan-2-carboxamide Traditional Name: N-[4-[(2,6-diketo-1,3,7-trimethyl-purin-8-yl)thio]phenyl]-2-furamide Formula: C19H17N5O4S MolecularWeight: 411.43438

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(N=C1SC3=CC=C(C=C3)NC(=O)C4=CC=CO4)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CN1C2=C(N=C1SC3=CC=C(C=C3)NC(=O)C4=CC=CO4)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C19H17N5O4S/c1-22-14-15(23(2)19(27)24(3)17(14)26)21-18(22)29-12-8-6-11(7-9-12)20-16(25)13-5-4-10-28-13/h4-10H,1-3H3,(H,20,25)