1-cyano-3-[2-[(6-oxidanylidene-3-phenyl-pyridazin-1-yl)methylsulfanyl]ethyl]-2-propyl-guanidine

Systemtic Name: 1-cyano-3-[2-[(6-oxidanylidene-3-phenyl-pyridazin-1-yl)methylsulfanyl]ethyl]-2-propyl-guanidine Openeye Name: 1-cyano-3-[2-[(6-oxo-3-phenyl-pyridazin-1-yl)methylsulfanyl]ethyl]-2-propyl-guanidine CAS Name: 1-cyano-3-[2-[(6-oxo-3-phenyl-1-pyridazinyl)methylthio]ethyl]-2-propylguanidine IUPAC Name: 1-cyano-3-[2-[(6-oxo-3-phenylpyridazin-1-yl)methylsulfanyl]ethyl]-2-propylguanidine Traditional Name: 1-cyano-3-[2-[(6-keto-3-phenyl-pyridazin-1-yl)methylthio]ethyl]-2-propyl-guanidine Formula: C18H22N6OS MolecularWeight: 370.47188

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Descriptors Computed from Structure

Canonical SMILES:

CCCN=C(NCCSCN1C(=O)C=CC(=N1)C2=CC=CC=C2)NC#N

Isomeric SMILES

CCCN=C(NCCSCN1C(=O)C=CC(=N1)C2=CC=CC=C2)NC#N

InChI

InChI=1S/C18H22N6OS/c1-2-10-20-18(22-13-19)21-11-12-26-14-24-17(25)9-8-16(23-24)15-6-4-3-5-7-15/h3-9H,2,10-12,14H2,1H3,(H2,20,21,22)