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

Systemtic Name: N3-[3-[3-(azocan-1-ylmethyl)phenoxy]propyl]-1-oxidanylidene-1,2,5-thiadiazole-3,4-diamine Openeye Name: N3-[3-[3-(azocan-1-ylmethyl)phenoxy]propyl]-1-oxo-1,2,5-thiadiazole-3,4-diamine CAS Name: N3-[3-[3-(1-azocanylmethyl)phenoxy]propyl]-1-oxo-1,2,5-thiadiazole-3,4-diamine IUPAC Name: 3-N-[3-[3-(azocan-1-ylmethyl)phenoxy]propyl]-1-oxo-1,2,5-thiadiazole-3,4-diamine Traditional Name: (4-amino-1-keto-1,2,5-thiadiazol-3-yl)-[3-[3-(azocan-1-ylmethyl)phenoxy]propyl]amine Formula: C19H29N5O2S MolecularWeight: 391.53086

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)CC2=CC(=CC=C2)OCCCNC3=NS(=O)N=C3N

Isomeric SMILES

C1CCCN(CCC1)CC2=CC(=CC=C2)OCCCNC3=NS(=O)N=C3N

InChI

InChI=1S/C19H29N5O2S/c20-18-19(23-27(25)22-18)21-10-7-13-26-17-9-6-8-16(14-17)15-24-11-4-2-1-3-5-12-24/h6,8-9,14H,1-5,7,10-13,15H2,(H2,20,22)(H,21,23)