2-ethyl-4-hexyl-1-oxidanylidene-5-(2-thiophen-2-ylethoxy)-2H-1,3-benzothiazol-3-amine

Systemtic Name: 2-ethyl-4-hexyl-1-oxidanylidene-5-(2-thiophen-2-ylethoxy)-2H-1,3-benzothiazol-3-amine Openeye Name: 2-ethyl-4-hexyl-1-oxo-5-[2-(2-thienyl)ethoxy]-2H-1,3-benzothiazol-3-amine CAS Name: 2-ethyl-4-hexyl-1-oxo-5-(2-thiophen-2-ylethoxy)-2H-1,3-benzothiazol-3-amine IUPAC Name: 2-ethyl-4-hexyl-1-oxo-5-(2-thiophen-2-ylethoxy)-2H-1,3-benzothiazol-3-amine Traditional Name: [2-ethyl-4-hexyl-1-keto-5-[2-(2-thienyl)ethoxy]-2H-1,3-benzothiazol-3-yl]amine Formula: C21H30N2O2S2 MolecularWeight: 406.6051

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=CC2=C1N(C(S2=O)CC)N)OCCC3=CC=CS3

Isomeric SMILES

CCCCCCC1=C(C=CC2=C1N(C(S2=O)CC)N)OCCC3=CC=CS3

InChI

InChI=1S/C21H30N2O2S2/c1-3-5-6-7-10-17-18(25-14-13-16-9-8-15-26-16)11-12-19-21(17)23(22)20(4-2)27(19)24/h8-9,11-12,15,20H,3-7,10,13-14,22H2,1-2H3