1-cyano-2-methyl-3-[2-[[3-(4-methylphenyl)-6-oxidanylidene-pyridazin-1-yl]methylsulfanyl]ethyl]guanidine

Systemtic Name: 1-cyano-2-methyl-3-[2-[[3-(4-methylphenyl)-6-oxidanylidene-pyridazin-1-yl]methylsulfanyl]ethyl]guanidine Openeye Name: 1-cyano-2-methyl-3-[2-[[6-oxo-3-(p-tolyl)pyridazin-1-yl]methylsulfanyl]ethyl]guanidine CAS Name: 1-cyano-2-methyl-3-[2-[[3-(4-methylphenyl)-6-oxo-1-pyridazinyl]methylthio]ethyl]guanidine IUPAC Name: 1-cyano-2-methyl-3-[2-[[3-(4-methylphenyl)-6-oxopyridazin-1-yl]methylsulfanyl]ethyl]guanidine Traditional Name: 1-cyano-3-[2-[[6-keto-3-(p-tolyl)pyridazin-1-yl]methylthio]ethyl]-2-methyl-guanidine Formula: C17H20N6OS MolecularWeight: 356.4453

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CSCCNC(=NC)NC#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CSCCNC(=NC)NC#N

InChI

InChI=1S/C17H20N6OS/c1-13-3-5-14(6-4-13)15-7-8-16(24)23(22-15)12-25-10-9-20-17(19-2)21-11-18/h3-8H,9-10,12H2,1-2H3,(H2,19,20,21)