(1R,4S)-2,4-dimethyl-1-pyridin-2-ylsulfanyl-1,4-dihydropyrazino[2,1-b]quinazoline-3,6-dione

Systemtic Name: (1R,4S)-2,4-dimethyl-1-pyridin-2-ylsulfanyl-1,4-dihydropyrazino[2,1-b]quinazoline-3,6-dione Openeye Name: (1R,4S)-2,4-dimethyl-1-(2-pyridylsulfanyl)-1,4-dihydropyrazino[2,1-b]quinazoline-3,6-dione CAS Name: (1R,4S)-2,4-dimethyl-1-(2-pyridinylthio)-1,4-dihydropyrazino[2,1-b]quinazoline-3,6-dione IUPAC Name: (1R,4S)-2,4-dimethyl-1-pyridin-2-ylsulfanyl-1,4-dihydropyrazino[2,1-b]quinazoline-3,6-dione Traditional Name: (1R,4S)-2,4-dimethyl-1-(2-pyridylthio)-1,4-dihydropyrazino[2,1-b]quinazoline-3,6-quinone Formula: C18H16N4O2S MolecularWeight: 352.41024

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C(C2=NC3=CC=CC=C3C(=O)N12)SC4=CC=CC=N4)C

Isomeric SMILES

C[C@H]1C(=O)N([C@@H](C2=NC3=CC=CC=C3C(=O)N12)SC4=CC=CC=N4)C

InChI

InChI=1S/C18H16N4O2S/c1-11-16(23)21(2)18(25-14-9-5-6-10-19-14)15-20-13-8-4-3-7-12(13)17(24)22(11)15/h3-11,18H,1-2H3/t11-,18+/m0/s1