4-chloranyl-3-nitro-N-[(5S)-5-oxidanylidene-2-phenyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide

Systemtic Name: 4-chloranyl-3-nitro-N-[(5S)-5-oxidanylidene-2-phenyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide Openeye Name: 4-chloro-3-nitro-N-[(5S)-5-oxo-2-phenyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide CAS Name: 4-chloro-3-nitro-N-[(5S)-5-oxo-2-phenyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide IUPAC Name: 4-chloro-3-nitro-N-[(5S)-5-oxo-2-phenyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide Traditional Name: 4-chloro-N-[(5S)-5-keto-2-phenyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-3-nitro-benzamide Formula: C18H13ClN4O4S MolecularWeight: 416.83822

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(N(N=C2CS1=O)C3=CC=CC=C3)NC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1C2=C(N(N=C2C[S@]1=O)C3=CC=CC=C3)NC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H13ClN4O4S/c19-14-7-6-11(8-16(14)23(25)26)18(24)20-17-13-9-28(27)10-15(13)21-22(17)12-4-2-1-3-5-12/h1-8H,9-10H2,(H,20,24)/t28-/m0/s1