N-(4-nitrophenyl)-3,4-dihydro-1H-phthalazine-2-carbothioamide

Systemtic Name: N-(4-nitrophenyl)-3,4-dihydro-1H-phthalazine-2-carbothioamide Openeye Name: N-(4-nitrophenyl)-3,4-dihydro-1H-phthalazine-2-carbothioamide CAS Name: N-(4-nitrophenyl)-3,4-dihydro-1H-phthalazine-2-carbothioamide IUPAC Name: N-(4-nitrophenyl)-3,4-dihydro-1H-phthalazine-2-carbothioamide Traditional Name: N-(4-nitrophenyl)-3,4-dihydro-1H-phthalazine-2-carbothioamide Formula: C15H14N4O2S MolecularWeight: 314.36226

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2CN(N1)C(=S)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1C2=CC=CC=C2CN(N1)C(=S)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H14N4O2S/c20-19(21)14-7-5-13(6-8-14)17-15(22)18-10-12-4-2-1-3-11(12)9-16-18/h1-8,16H,9-10H2,(H,17,22)