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

Systemtic Name: 6-[(1R)-1-phenylethyl]-2-sulfanylidene-5,6,7,8-tetrahydro-1H-pyrido[4,3-d]pyrimidin-6-ium-4-one Openeye Name: 6-[(1R)-1-phenylethyl]-2-thioxo-5,6,7,8-tetrahydro-1H-pyrido[4,3-d]pyrimidin-6-ium-4-one CAS Name: 6-[(1R)-1-phenylethyl]-2-sulfanylidene-5,6,7,8-tetrahydro-1H-pyrido[4,3-d]pyrimidin-6-ium-4-one IUPAC Name: 6-[(1R)-1-phenylethyl]-2-sulfanylidene-5,6,7,8-tetrahydro-1H-pyrido[4,3-d]pyrimidin-6-ium-4-one Traditional Name: 6-[(1R)-1-phenylethyl]-2-thioxo-5,6,7,8-tetrahydro-1H-pyrido[4,3-d]pyrimidin-6-ium-4-one Formula: C15H18N3OS+ MolecularWeight: 288.38792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)[NH+]2CCC3=C(C2)C(=O)NC(=S)N3

Isomeric SMILES

C[C@H](C1=CC=CC=C1)[NH+]2CCC3=C(C2)C(=O)NC(=S)N3

InChI

InChI=1S/C15H17N3OS/c1-10(11-5-3-2-4-6-11)18-8-7-13-12(9-18)14(19)17-15(20)16-13/h2-6,10H,7-9H2,1H3,(H2,16,17,19,20)/p+1/t10-/m1/s1