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

Systemtic Name: N3-[3-[3-(pyrrolidin-1-ylmethylsulfanyl)phenoxy]propyl]-1,2,5-thiadiazole-3,4-diamine Openeye Name: N3-[3-[3-(pyrrolidin-1-ylmethylsulfanyl)phenoxy]propyl]-1,2,5-thiadiazole-3,4-diamine CAS Name: N3-[3-[3-(1-pyrrolidinylmethylthio)phenoxy]propyl]-1,2,5-thiadiazole-3,4-diamine IUPAC Name: 3-N-[3-[3-(pyrrolidin-1-ylmethylsulfanyl)phenoxy]propyl]-1,2,5-thiadiazole-3,4-diamine Traditional Name: (4-amino-1,2,5-thiadiazol-3-yl)-[3-[3-(pyrrolidinomethylthio)phenoxy]propyl]amine Formula: C16H23N5OS2 MolecularWeight: 365.51672

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CSC2=CC=CC(=C2)OCCCNC3=NSN=C3N

Isomeric SMILES

C1CCN(C1)CSC2=CC=CC(=C2)OCCCNC3=NSN=C3N

InChI

InChI=1S/C16H23N5OS2/c17-15-16(20-24-19-15)18-7-4-10-22-13-5-3-6-14(11-13)23-12-21-8-1-2-9-21/h3,5-6,11H,1-2,4,7-10,12H2,(H2,17,19)(H,18,20)