7-methyl-1-morpholin-4-yl-3-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile

Systemtic Name: 7-methyl-1-morpholin-4-yl-3-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile Openeye Name: 7-methyl-1-morpholino-3-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile CAS Name: 7-methyl-1-(4-morpholinyl)-3-[[2-oxo-2-(1-pyrrolidinyl)ethyl]thio]-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile IUPAC Name: 7-methyl-1-morpholin-4-yl-3-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanyl-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile Traditional Name: 3-[(2-keto-2-pyrrolidino-ethyl)thio]-7-methyl-1-morpholino-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile Formula: C20H29N5O2S+2 MolecularWeight: 403.54156

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC2=C(C(=[NH+]C(=C2C1)N3CCOCC3)SCC(=O)N4CCCC4)C#N

Isomeric SMILES

C[NH+]1CCC2=C(C(=[NH+]C(=C2C1)N3CCOCC3)SCC(=O)N4CCCC4)C#N

InChI

InChI=1S/C20H27N5O2S/c1-23-7-4-15-16(12-21)20(28-14-18(26)24-5-2-3-6-24)22-19(17(15)13-23)25-8-10-27-11-9-25/h2-11,13-14H2,1H3/p+2