N4-methyl-1-oxidanylidene-N3-[3-[(phenylmethyl)-pyridin-2-yl-amino]propyl]-1,2,5-thiadiazole-3,4-diamine

Systemtic Name: N4-methyl-1-oxidanylidene-N3-[3-[(phenylmethyl)-pyridin-2-yl-amino]propyl]-1,2,5-thiadiazole-3,4-diamine Openeye Name: N3-[3-[benzyl(2-pyridyl)amino]propyl]-N4-methyl-1-oxo-1,2,5-thiadiazole-3,4-diamine CAS Name: N4-methyl-1-oxo-N3-[3-[(phenylmethyl)-(2-pyridinyl)amino]propyl]-1,2,5-thiadiazole-3,4-diamine IUPAC Name: 3-N-[3-[benzyl(pyridin-2-yl)amino]propyl]-4-N-methyl-1-oxo-1,2,5-thiadiazole-3,4-diamine Traditional Name: benzyl-[3-[[1-keto-4-(methylamino)-1,2,5-thiadiazol-3-yl]amino]propyl]-(2-pyridyl)amine Formula: C18H22N6OS MolecularWeight: 370.47188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC1=NS(=O)N=C1NCCCN(CC2=CC=CC=C2)C3=CC=CC=N3

Isomeric SMILES

CNC1=NS(=O)N=C1NCCCN(CC2=CC=CC=C2)C3=CC=CC=N3

InChI

InChI=1S/C18H22N6OS/c1-19-17-18(23-26(25)22-17)21-12-7-13-24(16-10-5-6-11-20-16)14-15-8-3-2-4-9-15/h2-6,8-11H,7,12-14H2,1H3,(H,19,22)(H,21,23)