N-hexyl-4-(2-sulfanylidene-3H-indazol-2-ium-1-yl)benzamide

Systemtic Name: N-hexyl-4-(2-sulfanylidene-3H-indazol-2-ium-1-yl)benzamide Openeye Name: N-hexyl-4-(2-thioxo-3H-indazol-2-ium-1-yl)benzamide CAS Name: N-hexyl-4-(2-sulfanylidene-3H-indazol-2-ium-1-yl)benzamide IUPAC Name: N-hexyl-4-(2-sulfanylidene-3H-indazol-2-ium-1-yl)benzamide Traditional Name: N-hexyl-4-(2-thioxoindazolin-2-ium-1-yl)benzamide Formula: C20H24N3OS+ MolecularWeight: 354.48906

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)C1=CC=C(C=C1)N2C3=CC=CC=C3C[N+]2=S

Isomeric SMILES

CCCCCCNC(=O)C1=CC=C(C=C1)N2C3=CC=CC=C3C[N+]2=S

InChI

InChI=1S/C20H23N3OS/c1-2-3-4-7-14-21-20(24)16-10-12-18(13-11-16)23-19-9-6-5-8-17(19)15-22(23)25/h5-6,8-13H,2-4,7,14-15H2,1H3/p+1