4-[2-(2-piperidin-2-ylbutan-2-yloxy)phenyl]sulfanylbenzene-1,2-diamine

Systemtic Name: 4-[2-(2-piperidin-2-ylbutan-2-yloxy)phenyl]sulfanylbenzene-1,2-diamine Openeye Name: 4-[2-[1-methyl-1-(2-piperidyl)propoxy]phenyl]sulfanylbenzene-1,2-diamine CAS Name: 4-[[2-[2-(2-piperidinyl)butan-2-yloxy]phenyl]thio]benzene-1,2-diamine IUPAC Name: 4-[2-(2-piperidin-2-ylbutan-2-yloxy)phenyl]sulfanylbenzene-1,2-diamine Traditional Name: [2-amino-4-[[2-[1-methyl-1-(2-piperidyl)propoxy]phenyl]thio]phenyl]amine Formula: C21H29N3OS MolecularWeight: 371.53946

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C1CCCCN1)OC2=CC=CC=C2SC3=CC(=C(C=C3)N)N

Isomeric SMILES

CCC(C)(C1CCCCN1)OC2=CC=CC=C2SC3=CC(=C(C=C3)N)N

InChI

InChI=1S/C21H29N3OS/c1-3-21(2,20-10-6-7-13-24-20)25-18-8-4-5-9-19(18)26-15-11-12-16(22)17(23)14-15/h4-5,8-9,11-12,14,20,24H,3,6-7,10,13,22-23H2,1-2H3