2-(4-tert-butylpyridin-1-ium-1-yl)-1-(3-chlorophenyl)-3-(naphthalen-1-ylamino)-3-sulfanylidene-prop-1-en-1-olate

Systemtic Name: 2-(4-tert-butylpyridin-1-ium-1-yl)-1-(3-chlorophenyl)-3-(naphthalen-1-ylamino)-3-sulfanylidene-prop-1-en-1-olate Openeye Name: 2-(4-tert-butylpyridin-1-ium-1-yl)-1-(3-chlorophenyl)-3-(1-naphthylamino)-3-thioxo-prop-1-en-1-olate CAS Name: 2-(4-tert-butyl-1-pyridin-1-iumyl)-1-(3-chlorophenyl)-3-(1-naphthalenylamino)-3-sulfanylidene-1-propen-1-olate IUPAC Name: 2-(4-tert-butylpyridin-1-ium-1-yl)-1-(3-chlorophenyl)-3-(naphthalen-1-ylamino)-3-sulfanylideneprop-1-en-1-olate Traditional Name: 2-(4-tert-butylpyridin-1-ium-1-yl)-1-(3-chlorophenyl)-3-(1-naphthylamino)-3-thioxo-prop-1-en-1-olate Formula: C28H25ClN2OS MolecularWeight: 473.0289

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=[N+](C=C1)C(=C(C2=CC(=CC=C2)Cl)[O-])C(=S)NC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(C)(C)C1=CC=[N+](C=C1)C(=C(C2=CC(=CC=C2)Cl)[O-])C(=S)NC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C28H25ClN2OS/c1-28(2,3)21-14-16-31(17-15-21)25(26(32)20-10-6-11-22(29)18-20)27(33)30-24-13-7-9-19-8-4-5-12-23(19)24/h4-18H,1-3H3,(H-,30,32,33)