7-methoxy-2-[2-oxidanylidene-2-(2-oxidanylidene-1,3-benzoxazol-3-yl)ethyl]sulfanyl-quinoline-3-carbonitrile

Systemtic Name: 7-methoxy-2-[2-oxidanylidene-2-(2-oxidanylidene-1,3-benzoxazol-3-yl)ethyl]sulfanyl-quinoline-3-carbonitrile Openeye Name: 7-methoxy-2-[2-oxo-2-(2-oxo-1,3-benzoxazol-3-yl)ethyl]sulfanyl-quinoline-3-carbonitrile CAS Name: 7-methoxy-2-[[2-oxo-2-(2-oxo-1,3-benzoxazol-3-yl)ethyl]thio]-3-quinolinecarbonitrile IUPAC Name: 7-methoxy-2-[2-oxo-2-(2-oxo-1,3-benzoxazol-3-yl)ethyl]sulfanylquinoline-3-carbonitrile Traditional Name: 2-[[2-keto-2-(2-keto-1,3-benzoxazol-3-yl)ethyl]thio]-7-methoxy-quinoline-3-carbonitrile Formula: C20H13N3O4S MolecularWeight: 391.39992

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C(C(=N2)SCC(=O)N3C4=CC=CC=C4OC3=O)C#N

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(C(=N2)SCC(=O)N3C4=CC=CC=C4OC3=O)C#N

InChI

InChI=1S/C20H13N3O4S/c1-26-14-7-6-12-8-13(10-21)19(22-15(12)9-14)28-11-18(24)23-16-4-2-3-5-17(16)27-20(23)25/h2-9H,11H2,1H3