N3-[3-[4-(dimethylaminomethyl)pyridin-2-yl]oxypropyl]-1-oxidanylidene-1,2,5-thiadiazole-3,4-diamine

Systemtic Name: N3-[3-[4-(dimethylaminomethyl)pyridin-2-yl]oxypropyl]-1-oxidanylidene-1,2,5-thiadiazole-3,4-diamine Openeye Name: N3-[3-[[4-(dimethylaminomethyl)-2-pyridyl]oxy]propyl]-1-oxo-1,2,5-thiadiazole-3,4-diamine CAS Name: N3-[3-[[4-(dimethylaminomethyl)-2-pyridinyl]oxy]propyl]-1-oxo-1,2,5-thiadiazole-3,4-diamine IUPAC Name: 3-N-[3-[4-(dimethylaminomethyl)pyridin-2-yl]oxypropyl]-1-oxo-1,2,5-thiadiazole-3,4-diamine Traditional Name: [2-[3-[(4-amino-1-keto-1,2,5-thiadiazol-3-yl)amino]propoxy]-4-pyridyl]methyl-dimethyl-amine Formula: C13H20N6O2S MolecularWeight: 324.4019

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC(=NC=C1)OCCCNC2=NS(=O)N=C2N

Isomeric SMILES

CN(C)CC1=CC(=NC=C1)OCCCNC2=NS(=O)N=C2N

InChI

InChI=1S/C13H20N6O2S/c1-19(2)9-10-4-6-15-11(8-10)21-7-3-5-16-13-12(14)17-22(20)18-13/h4,6,8H,3,5,7,9H2,1-2H3,(H2,14,17)(H,16,18)