2-(4-tert-butylpyridin-1-ium-1-yl)-1-(4-nitrophenyl)-3-phenylazanyl-3-sulfanylidene-prop-1-en-1-olate

Systemtic Name: 2-(4-tert-butylpyridin-1-ium-1-yl)-1-(4-nitrophenyl)-3-phenylazanyl-3-sulfanylidene-prop-1-en-1-olate Openeye Name: 3-anilino-2-(4-tert-butylpyridin-1-ium-1-yl)-1-(4-nitrophenyl)-3-thioxo-prop-1-en-1-olate CAS Name: 3-anilino-2-(4-tert-butyl-1-pyridin-1-iumyl)-1-(4-nitrophenyl)-3-sulfanylidene-1-propen-1-olate IUPAC Name: 3-anilino-2-(4-tert-butylpyridin-1-ium-1-yl)-1-(4-nitrophenyl)-3-sulfanylideneprop-1-en-1-olate Traditional Name: 3-anilino-2-(4-tert-butylpyridin-1-ium-1-yl)-1-(4-nitrophenyl)-3-thioxo-prop-1-en-1-olate Formula: C24H23N3O3S MolecularWeight: 433.52272

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=[N+](C=C1)C(=C(C2=CC=C(C=C2)[N+](=O)[O-])[O-])C(=S)NC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC=[N+](C=C1)C(=C(C2=CC=C(C=C2)[N+](=O)[O-])[O-])C(=S)NC3=CC=CC=C3

InChI

InChI=1S/C24H23N3O3S/c1-24(2,3)18-13-15-26(16-14-18)21(23(31)25-19-7-5-4-6-8-19)22(28)17-9-11-20(12-10-17)27(29)30/h4-16H,1-3H3,(H-,25,28,31)