N-(1,3-benzothiazol-2-ylsulfanyl)-N-octyl-aniline

Systemtic Name: N-(1,3-benzothiazol-2-ylsulfanyl)-N-octyl-aniline Openeye Name: N-(1,3-benzothiazol-2-ylsulfanyl)-N-octyl-aniline CAS Name: N-octyl-N-phenyl-1,3-benzothiazole-2-sulfenamide IUPAC Name: N-(1,3-benzothiazol-2-ylsulfanyl)-N-octylaniline Traditional Name: (1,3-benzothiazol-2-ylthio)-octyl-phenyl-amine Formula: C21H26N2S2 MolecularWeight: 370.57454

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN(C1=CC=CC=C1)SC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCCCCCCCN(C1=CC=CC=C1)SC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C21H26N2S2/c1-2-3-4-5-6-12-17-23(18-13-8-7-9-14-18)25-21-22-19-15-10-11-16-20(19)24-21/h7-11,13-16H,2-6,12,17H2,1H3