2-(1-azanylethyl)-5-[2-(4-bromophenyl)ethoxy]-3-hexyl-1-oxidanylidene-2H-1,3-benzothiazol-4-ol

Systemtic Name: 2-(1-azanylethyl)-5-[2-(4-bromophenyl)ethoxy]-3-hexyl-1-oxidanylidene-2H-1,3-benzothiazol-4-ol Openeye Name: 2-(1-aminoethyl)-5-[2-(4-bromophenyl)ethoxy]-3-hexyl-1-oxo-2H-1,3-benzothiazol-4-ol CAS Name: 2-(1-aminoethyl)-5-[2-(4-bromophenyl)ethoxy]-3-hexyl-1-oxo-2H-1,3-benzothiazol-4-ol IUPAC Name: 2-(1-aminoethyl)-5-[2-(4-bromophenyl)ethoxy]-3-hexyl-1-oxo-2H-1,3-benzothiazol-4-ol Traditional Name: 2-(1-aminoethyl)-5-[2-(4-bromophenyl)ethoxy]-3-hexyl-1-keto-2H-1,3-benzothiazol-4-ol Formula: C23H31BrN2O3S MolecularWeight: 495.47284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(S(=O)C2=C1C(=C(C=C2)OCCC3=CC=C(C=C3)Br)O)C(C)N

Isomeric SMILES

CCCCCCN1C(S(=O)C2=C1C(=C(C=C2)OCCC3=CC=C(C=C3)Br)O)C(C)N

InChI

InChI=1S/C23H31BrN2O3S/c1-3-4-5-6-14-26-21-20(30(28)23(26)16(2)25)12-11-19(22(21)27)29-15-13-17-7-9-18(24)10-8-17/h7-12,16,23,27H,3-6,13-15,25H2,1-2H3