2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitro-pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitro-pyrido[1,2-a]pyrimidin-4-one Openeye Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitro-pyrido[1,2-a]pyrimidin-4-one CAS Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]-3-nitro-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitropyrido[1,2-a]pyrimidin-4-one Traditional Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]-3-nitro-pyrido[1,2-a]pyrimidin-4-one Formula: C16H14N6O3S MolecularWeight: 370.38576

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2C3CC3)SC4=C(C(=O)N5C=CC=CC5=N4)[N+](=O)[O-]

Isomeric SMILES

C1CC1C2=NN=C(N2C3CC3)SC4=C(C(=O)N5C=CC=CC5=N4)[N+](=O)[O-]

InChI

InChI=1S/C16H14N6O3S/c23-15-12(22(24)25)14(17-11-3-1-2-8-20(11)15)26-16-19-18-13(9-4-5-9)21(16)10-6-7-10/h1-3,8-10H,4-7H2