(E)-N-[6-(diphenylcarbamoylamino)hexyl]-3-pyridin-3-yl-prop-2-enamide

Systemtic Name: (E)-N-[6-(diphenylcarbamoylamino)hexyl]-3-pyridin-3-yl-prop-2-enamide Openeye Name: (E)-N-[6-(diphenylcarbamoylamino)hexyl]-3-(3-pyridyl)prop-2-enamide CAS Name: (E)-N-[6-[[oxo-(N-phenylanilino)methyl]amino]hexyl]-3-(3-pyridinyl)-2-propenamide IUPAC Name: (E)-N-[6-(diphenylcarbamoylamino)hexyl]-3-pyridin-3-ylprop-2-enamide Traditional Name: (E)-N-[6-(diphenylcarbamoylamino)hexyl]-3-(3-pyridyl)acrylamide Formula: C27H30N4O2 MolecularWeight: 442.5527

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(C2=CC=CC=C2)C(=O)NCCCCCCNC(=O)C=CC3=CN=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)N(C2=CC=CC=C2)C(=O)NCCCCCCNC(=O)/C=C/C3=CN=CC=C3

InChI

InChI=1S/C27H30N4O2/c32-26(18-17-23-12-11-19-28-22-23)29-20-9-1-2-10-21-30-27(33)31(24-13-5-3-6-14-24)25-15-7-4-8-16-25/h3-8,11-19,22H,1-2,9-10,20-21H2,(H,29,32)(H,30,33)/b18-17+