1-cyano-2-naphthalen-1-yl-3-[4-[2-[[(2R)-2-oxidanyl-2-pyridin-3-yl-ethyl]amino]ethyl]phenyl]guanidine

Systemtic Name: 1-cyano-2-naphthalen-1-yl-3-[4-[2-[[(2R)-2-oxidanyl-2-pyridin-3-yl-ethyl]amino]ethyl]phenyl]guanidine Openeye Name: 1-cyano-3-[4-[2-[[(2R)-2-hydroxy-2-(3-pyridyl)ethyl]amino]ethyl]phenyl]-2-(1-naphthyl)guanidine CAS Name: 1-cyano-3-[4-[2-[[(2R)-2-hydroxy-2-(3-pyridinyl)ethyl]amino]ethyl]phenyl]-2-(1-naphthalenyl)guanidine IUPAC Name: 1-cyano-3-[4-[2-[[(2R)-2-hydroxy-2-pyridin-3-ylethyl]amino]ethyl]phenyl]-2-naphthalen-1-ylguanidine Traditional Name: 1-cyano-3-[4-[2-[[(2R)-2-hydroxy-2-(3-pyridyl)ethyl]amino]ethyl]phenyl]-2-(1-naphthyl)guanidine Formula: C27H26N6O MolecularWeight: 450.53494

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2N=C(NC#N)NC3=CC=C(C=C3)CCNCC(C4=CN=CC=C4)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2N=C(NC#N)NC3=CC=C(C=C3)CCNC[C@@H](C4=CN=CC=C4)O

InChI

InChI=1S/C27H26N6O/c28-19-31-27(33-25-9-3-6-21-5-1-2-8-24(21)25)32-23-12-10-20(11-13-23)14-16-30-18-26(34)22-7-4-15-29-17-22/h1-13,15,17,26,30,34H,14,16,18H2,(H2,31,32,33)/t26-/m0/s1