(E)-N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-3-thiophen-2-yl-prop-2-enamide

Systemtic Name: (E)-N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-3-thiophen-2-yl-prop-2-enamide Openeye Name: (E)-N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-3-(2-thienyl)prop-2-enamide CAS Name: (E)-N-[3-[6-(1-azepanyl)-3-pyridazinyl]phenyl]-3-thiophen-2-yl-2-propenamide IUPAC Name: (E)-N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-3-thiophen-2-ylprop-2-enamide Traditional Name: (E)-N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-3-(2-thienyl)acrylamide Formula: C23H24N4OS MolecularWeight: 404.52786

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NN=C(C=C2)C3=CC(=CC=C3)NC(=O)C=CC4=CC=CS4

Isomeric SMILES

C1CCCN(CC1)C2=NN=C(C=C2)C3=CC(=CC=C3)NC(=O)/C=C/C4=CC=CS4

InChI

InChI=1S/C23H24N4OS/c28-23(13-10-20-9-6-16-29-20)24-19-8-5-7-18(17-19)21-11-12-22(26-25-21)27-14-3-1-2-4-15-27/h5-13,16-17H,1-4,14-15H2,(H,24,28)/b13-10+