3-tert-butyl-7-(3-nitrophenyl)-8H-[1,2,4]triazino[3,4-b][1,3,4]thiadiazin-4-one

Systemtic Name: 3-tert-butyl-7-(3-nitrophenyl)-8H-[1,2,4]triazino[3,4-b][1,3,4]thiadiazin-4-one Openeye Name: 3-tert-butyl-7-(3-nitrophenyl)-8H-[1,2,4]triazino[3,4-b][1,3,4]thiadiazin-4-one CAS Name: 3-tert-butyl-7-(3-nitrophenyl)-8H-[1,2,4]triazino[3,4-b][1,3,4]thiadiazin-4-one IUPAC Name: 3-tert-butyl-7-(3-nitrophenyl)-8H-[1,2,4]triazino[3,4-b][1,3,4]thiadiazin-4-one Traditional Name: 3-tert-butyl-7-(3-nitrophenyl)-8H-[1,2,4]triazino[3,4-b][1,3,4]thiadiazin-4-one Formula: C15H15N5O3S MolecularWeight: 345.3763

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN=C2N(C1=O)N=C(CS2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=NN=C2N(C1=O)N=C(CS2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H15N5O3S/c1-15(2,3)12-13(21)19-14(17-16-12)24-8-11(18-19)9-5-4-6-10(7-9)20(22)23/h4-7H,8H2,1-3H3