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

Systemtic Name: N3-[3-[3-(diethylaminomethyl)phenoxy]propyl]-1-oxidanylidene-1,2,5-thiadiazole-3,4-diamine Openeye Name: N3-[3-[3-(diethylaminomethyl)phenoxy]propyl]-1-oxo-1,2,5-thiadiazole-3,4-diamine CAS Name: N3-[3-[3-(diethylaminomethyl)phenoxy]propyl]-1-oxo-1,2,5-thiadiazole-3,4-diamine IUPAC Name: 3-N-[3-[3-(diethylaminomethyl)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]benzyl]-diethyl-amine Formula: C16H25N5O2S MolecularWeight: 351.467

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CC(=CC=C1)OCCCNC2=NS(=O)N=C2N

Isomeric SMILES

CCN(CC)CC1=CC(=CC=C1)OCCCNC2=NS(=O)N=C2N

InChI

InChI=1S/C16H25N5O2S/c1-3-21(4-2)12-13-7-5-8-14(11-13)23-10-6-9-18-16-15(17)19-24(22)20-16/h5,7-8,11H,3-4,6,9-10,12H2,1-2H3,(H2,17,19)(H,18,20)