N3-[3-[3-(dimethylaminomethylsulfanyl)phenoxy]propyl]-1-oxidanylidene-1,2,5-thiadiazole-3,4-diamine

Systemtic Name: N3-[3-[3-(dimethylaminomethylsulfanyl)phenoxy]propyl]-1-oxidanylidene-1,2,5-thiadiazole-3,4-diamine Openeye Name: N3-[3-[3-(dimethylaminomethylsulfanyl)phenoxy]propyl]-1-oxo-1,2,5-thiadiazole-3,4-diamine CAS Name: N3-[3-[3-(dimethylaminomethylthio)phenoxy]propyl]-1-oxo-1,2,5-thiadiazole-3,4-diamine IUPAC Name: 3-N-[3-[3-(dimethylaminomethylsulfanyl)phenoxy]propyl]-1-oxo-1,2,5-thiadiazole-3,4-diamine Traditional Name: [[3-[3-[(4-amino-1-keto-1,2,5-thiadiazol-3-yl)amino]propoxy]phenyl]thio]methyl-dimethyl-amine Formula: C14H21N5O2S2 MolecularWeight: 355.47884

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CSC1=CC=CC(=C1)OCCCNC2=NS(=O)N=C2N

Isomeric SMILES

CN(C)CSC1=CC=CC(=C1)OCCCNC2=NS(=O)N=C2N

InChI

InChI=1S/C14H21N5O2S2/c1-19(2)10-22-12-6-3-5-11(9-12)21-8-4-7-16-14-13(15)17-23(20)18-14/h3,5-6,9H,4,7-8,10H2,1-2H3,(H2,15,17)(H,16,18)