bis(azanyl)methylidene-[2-[(3-chloranyl-4-methoxy-phenyl)methylsulfanyl]ethyl]azanium

Systemtic Name: bis(azanyl)methylidene-[2-[(3-chloranyl-4-methoxy-phenyl)methylsulfanyl]ethyl]azanium Openeye Name: 2-[(3-chloro-4-methoxy-phenyl)methylsulfanyl]ethyl-(diaminomethylene)ammonium CAS Name: 2-[(3-chloro-4-methoxyphenyl)methylthio]ethyl-(diaminomethylidene)ammonium IUPAC Name: 2-[(3-chloro-4-methoxyphenyl)methylsulfanyl]ethyl-(diaminomethylidene)azanium Traditional Name: 2-[(3-chloro-4-methoxy-benzyl)thio]ethyl-(diaminomethylene)ammonium Formula: C11H17ClN3OS+ MolecularWeight: 274.79018

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CSCC[NH+]=C(N)N)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CSCC[NH+]=C(N)N)Cl

InChI

InChI=1S/C11H16ClN3OS/c1-16-10-3-2-8(6-9(10)12)7-17-5-4-15-11(13)14/h2-3,6H,4-5,7H2,1H3,(H4,13,14,15)/p+1