4-[[3-[(4-azanyl-1-oxidanylidene-1,2,5-thiadiazol-3-yl)amino]propyl-pyridin-2-yl-amino]methyl]phenol

Systemtic Name: 4-[[3-[(4-azanyl-1-oxidanylidene-1,2,5-thiadiazol-3-yl)amino]propyl-pyridin-2-yl-amino]methyl]phenol Openeye Name: 4-[[3-[(4-amino-1-oxo-1,2,5-thiadiazol-3-yl)amino]propyl-(2-pyridyl)amino]methyl]phenol CAS Name: 4-[[3-[(4-amino-1-oxo-1,2,5-thiadiazol-3-yl)amino]propyl-(2-pyridinyl)amino]methyl]phenol IUPAC Name: 4-[[3-[(4-amino-1-oxo-1,2,5-thiadiazol-3-yl)amino]propyl-pyridin-2-ylamino]methyl]phenol Traditional Name: 4-[[3-[(4-amino-1-keto-1,2,5-thiadiazol-3-yl)amino]propyl-(2-pyridyl)amino]methyl]phenol Formula: C17H20N6O2S MolecularWeight: 372.4447

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)N(CCCNC2=NS(=O)N=C2N)CC3=CC=C(C=C3)O

Isomeric SMILES

C1=CC=NC(=C1)N(CCCNC2=NS(=O)N=C2N)CC3=CC=C(C=C3)O

InChI

InChI=1S/C17H20N6O2S/c18-16-17(22-26(25)21-16)20-10-3-11-23(15-4-1-2-9-19-15)12-13-5-7-14(24)8-6-13/h1-2,4-9,24H,3,10-12H2,(H2,18,21)(H,20,22)