N-(1,3-benzothiazol-2-ylsulfanyl)-N-octan-2-yl-aniline

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)N(C1=CC=CC=C1)SC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCCCCCC(C)N(C1=CC=CC=C1)SC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C21H26N2S2/c1-3-4-5-7-12-17(2)23(18-13-8-6-9-14-18)25-21-22-19-15-10-11-16-20(19)24-21/h6,8-11,13-17H,3-5,7,12H2,1-2H3