bis(azanyl)methylidene-[2-[(4-butoxyphenyl)methylsulfanyl]ethyl]azanium

Systemtic Name: bis(azanyl)methylidene-[2-[(4-butoxyphenyl)methylsulfanyl]ethyl]azanium Openeye Name: 2-[(4-butoxyphenyl)methylsulfanyl]ethyl-(diaminomethylene)ammonium CAS Name: 2-[(4-butoxyphenyl)methylthio]ethyl-(diaminomethylidene)ammonium IUPAC Name: 2-[(4-butoxyphenyl)methylsulfanyl]ethyl-(diaminomethylidene)azanium Traditional Name: 2-[(4-butoxybenzyl)thio]ethyl-(diaminomethylene)ammonium Formula: C14H24N3OS+ MolecularWeight: 282.42486

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)CSCC[NH+]=C(N)N

Isomeric SMILES

CCCCOC1=CC=C(C=C1)CSCC[NH+]=C(N)N

InChI

InChI=1S/C14H23N3OS/c1-2-3-9-18-13-6-4-12(5-7-13)11-19-10-8-17-14(15)16/h4-7H,2-3,8-11H2,1H3,(H4,15,16,17)/p+1