(E)-3-[3-[[(4-methoxyphenyl)sulfonylmethyl-pyridin-3-yl-amino]carbamoyl]-5-methyl-phenyl]-N-methyl-N-octyl-prop-2-enamide

Systemtic Name: (E)-3-[3-[[(4-methoxyphenyl)sulfonylmethyl-pyridin-3-yl-amino]carbamoyl]-5-methyl-phenyl]-N-methyl-N-octyl-prop-2-enamide Openeye Name: (E)-3-[3-[[(4-methoxyphenyl)sulfonylmethyl-(3-pyridyl)amino]carbamoyl]-5-methyl-phenyl]-N-methyl-N-octyl-prop-2-enamide CAS Name: (E)-3-[3-[[2-[(4-methoxyphenyl)sulfonylmethyl]-2-(3-pyridinyl)hydrazinyl]-oxomethyl]-5-methylphenyl]-N-methyl-N-octyl-2-propenamide IUPAC Name: (E)-3-[3-[[(4-methoxyphenyl)sulfonylmethyl-pyridin-3-ylamino]carbamoyl]-5-methylphenyl]-N-methyl-N-octylprop-2-enamide Traditional Name: (E)-3-[3-[[(4-methoxyphenyl)sulfonylmethyl-(3-pyridyl)amino]carbamoyl]-5-methyl-phenyl]-N-methyl-N-octyl-acrylamide Formula: C33H42N4O5S MolecularWeight: 606.77538

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN(C)C(=O)C=CC1=CC(=CC(=C1)C)C(=O)NN(CS(=O)(=O)C2=CC=C(C=C2)OC)C3=CN=CC=C3

Isomeric SMILES

CCCCCCCCN(C)C(=O)/C=C/C1=CC(=CC(=C1)C)C(=O)NN(CS(=O)(=O)C2=CC=C(C=C2)OC)C3=CN=CC=C3

InChI

InChI=1S/C33H42N4O5S/c1-5-6-7-8-9-10-20-36(3)32(38)18-13-27-21-26(2)22-28(23-27)33(39)35-37(29-12-11-19-34-24-29)25-43(40,41)31-16-14-30(42-4)15-17-31/h11-19,21-24H,5-10,20,25H2,1-4H3,(H,35,39)/b18-13+