6-methoxy-2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-quinoline-3-carbonitrile

Systemtic Name: 6-methoxy-2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-quinoline-3-carbonitrile Openeye Name: 6-methoxy-2-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-quinoline-3-carbonitrile CAS Name: 6-methoxy-2-[[2-oxo-2-(1-pyrrolidinyl)ethyl]thio]-3-quinolinecarbonitrile IUPAC Name: 6-methoxy-2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanylquinoline-3-carbonitrile Traditional Name: 2-[(2-keto-2-pyrrolidino-ethyl)thio]-6-methoxy-quinoline-3-carbonitrile Formula: C17H17N3O2S MolecularWeight: 327.40078

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)N3CCCC3

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)N3CCCC3

InChI

InChI=1S/C17H17N3O2S/c1-22-14-4-5-15-12(9-14)8-13(10-18)17(19-15)23-11-16(21)20-6-2-3-7-20/h4-5,8-9H,2-3,6-7,11H2,1H3