4-(cyclohexylamino)-2-[2-oxidanyl-3-(propan-2-ylamino)propoxy]pyridine-3-carbonitrile dihydrochloride

Systemtic Name: 4-(cyclohexylamino)-2-[2-oxidanyl-3-(propan-2-ylamino)propoxy]pyridine-3-carbonitrile dihydrochloride Openeye Name: 4-(cyclohexylamino)-2-[2-hydroxy-3-(isopropylamino)propoxy]pyridine-3-carbonitrile dihydrochloride CAS Name: 4-(cyclohexylamino)-2-[2-hydroxy-3-(propan-2-ylamino)propoxy]-3-pyridinecarbonitrile dihydrochloride IUPAC Name: 4-(cyclohexylamino)-2-[2-hydroxy-3-(propan-2-ylamino)propoxy]pyridine-3-carbonitrile dihydrochloride Traditional Name: 4-(cyclohexylamino)-2-[2-hydroxy-3-(isopropylamino)propoxy]nicotinonitrile dihydrochloride Formula: C18H30Cl2N4O2 MolecularWeight: 405.3624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(COC1=NC=CC(=C1C#N)NC2CCCCC2)O.Cl.Cl

Isomeric SMILES

CC(C)NCC(COC1=NC=CC(=C1C#N)NC2CCCCC2)O.Cl.Cl

InChI

InChI=1S/C18H28N4O2.2ClH/c1-13(2)21-11-15(23)12-24-18-16(10-19)17(8-9-20-18)22-14-6-4-3-5-7-14;;/h8-9,13-15,21,23H,3-7,11-12H2,1-2H3,(H,20,22);2*1H