N-carbamimidoyl-N-[3-(3-piperidin-1-ylpropoxy)phenyl]-2-pyridin-3-yl-prop-2-enamide

Systemtic Name: N-carbamimidoyl-N-[3-(3-piperidin-1-ylpropoxy)phenyl]-2-pyridin-3-yl-prop-2-enamide Openeye Name: N-carbamimidoyl-N-[3-[3-(1-piperidyl)propoxy]phenyl]-2-(3-pyridyl)prop-2-enamide CAS Name: N-carbamimidoyl-N-[3-[3-(1-piperidinyl)propoxy]phenyl]-2-(3-pyridinyl)-2-propenamide IUPAC Name: N-carbamimidoyl-N-[3-(3-piperidin-1-ylpropoxy)phenyl]-2-pyridin-3-ylprop-2-enamide Traditional Name: N-amidino-N-[3-(3-piperidinopropoxy)phenyl]-2-(3-pyridyl)acrylamide Formula: C23H29N5O2 MolecularWeight: 407.50866

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C1=CN=CC=C1)C(=O)N(C2=CC(=CC=C2)OCCCN3CCCCC3)C(=N)N

Isomeric SMILES

C=C(C1=CN=CC=C1)C(=O)N(C2=CC(=CC=C2)OCCCN3CCCCC3)C(=N)N

InChI

InChI=1S/C23H29N5O2/c1-18(19-8-6-11-26-17-19)22(29)28(23(24)25)20-9-5-10-21(16-20)30-15-7-14-27-12-3-2-4-13-27/h5-6,8-11,16-17H,1-4,7,12-15H2,(H3,24,25)