3-(7-azanyl-5,9-diethyl-tridecan-7-yl)-1,3-benzothiazole-2-thione

Systemtic Name: 3-(7-azanyl-5,9-diethyl-tridecan-7-yl)-1,3-benzothiazole-2-thione Openeye Name: 3-[1-amino-3-ethyl-1-(2-ethylhexyl)heptyl]-1,3-benzothiazole-2-thione CAS Name: 3-(7-amino-5,9-diethyltridecan-7-yl)-1,3-benzothiazole-2-thione IUPAC Name: 3-(7-amino-5,9-diethyltridecan-7-yl)-1,3-benzothiazole-2-thione Traditional Name: 3-[1-amino-3-ethyl-1-(2-ethylhexyl)heptyl]-1,3-benzothiazole-2-thione Formula: C24H40N2S2 MolecularWeight: 420.7178

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CC(CC(CC)CCCC)(N)N1C2=CC=CC=C2SC1=S

Isomeric SMILES

CCCCC(CC)CC(CC(CC)CCCC)(N)N1C2=CC=CC=C2SC1=S

InChI

InChI=1S/C24H40N2S2/c1-5-9-13-19(7-3)17-24(25,18-20(8-4)14-10-6-2)26-21-15-11-12-16-22(21)28-23(26)27/h11-12,15-16,19-20H,5-10,13-14,17-18,25H2,1-4H3