6-butyl-2-sulfanylidene-5,6,7,8-tetrahydro-1H-pyrido[4,3-d]pyrimidin-6-ium-4-one

Systemtic Name: 6-butyl-2-sulfanylidene-5,6,7,8-tetrahydro-1H-pyrido[4,3-d]pyrimidin-6-ium-4-one Openeye Name: 6-butyl-2-thioxo-5,6,7,8-tetrahydro-1H-pyrido[4,3-d]pyrimidin-6-ium-4-one CAS Name: 6-butyl-2-sulfanylidene-5,6,7,8-tetrahydro-1H-pyrido[4,3-d]pyrimidin-6-ium-4-one IUPAC Name: 6-butyl-2-sulfanylidene-5,6,7,8-tetrahydro-1H-pyrido[4,3-d]pyrimidin-6-ium-4-one Traditional Name: 6-butyl-2-thioxo-5,6,7,8-tetrahydro-1H-pyrido[4,3-d]pyrimidin-6-ium-4-one Formula: C11H18N3OS+ MolecularWeight: 240.34512

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+]1CCC2=C(C1)C(=O)NC(=S)N2

Isomeric SMILES

CCCC[NH+]1CCC2=C(C1)C(=O)NC(=S)N2

InChI

InChI=1S/C11H17N3OS/c1-2-3-5-14-6-4-9-8(7-14)10(15)13-11(16)12-9/h2-7H2,1H3,(H2,12,13,15,16)/p+1