2-(1,3-benzothiazol-2-ylsulfanyl)-5-nitro-benzaldehyde

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-5-nitro-benzaldehyde Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-5-nitro-benzaldehyde CAS Name: 2-(1,3-benzothiazol-2-ylthio)-5-nitrobenzaldehyde IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-5-nitrobenzaldehyde Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-5-nitro-benzaldehyde Formula: C14H8N2O3S2 MolecularWeight: 316.35492

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SC3=C(C=C(C=C3)[N+](=O)[O-])C=O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SC3=C(C=C(C=C3)[N+](=O)[O-])C=O

InChI

InChI=1S/C14H8N2O3S2/c17-8-9-7-10(16(18)19)5-6-12(9)20-14-15-11-3-1-2-4-13(11)21-14/h1-8H