(2-sulfanylidenepyridin-1-yl) 3-[butyl(3,3-diphenylprop-2-enyl)amino]-3-oxidanylidene-propanoate

Systemtic Name: (2-sulfanylidenepyridin-1-yl) 3-[butyl(3,3-diphenylprop-2-enyl)amino]-3-oxidanylidene-propanoate Openeye Name: (2-thioxo-1-pyridyl) 3-[butyl(3,3-diphenylallyl)amino]-3-oxo-propanoate CAS Name: 3-[butyl(3,3-diphenylprop-2-enyl)amino]-3-oxopropanoic acid (2-sulfanylidene-1-pyridinyl) ester IUPAC Name: (2-sulfanylidenepyridin-1-yl) 3-[butyl(3,3-diphenylprop-2-enyl)amino]-3-oxopropanoate Traditional Name: 3-[butyl(3,3-diphenylallyl)amino]-3-keto-propionic acid (2-thioxo-1-pyridyl) ester Formula: C27H28N2O3S MolecularWeight: 460.58782

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC=C(C1=CC=CC=C1)C2=CC=CC=C2)C(=O)CC(=O)ON3C=CC=CC3=S

Isomeric SMILES

CCCCN(CC=C(C1=CC=CC=C1)C2=CC=CC=C2)C(=O)CC(=O)ON3C=CC=CC3=S

InChI

InChI=1S/C27H28N2O3S/c1-2-3-18-28(25(30)21-27(31)32-29-19-11-10-16-26(29)33)20-17-24(22-12-6-4-7-13-22)23-14-8-5-9-15-23/h4-17,19H,2-3,18,20-21H2,1H3