N-[2-butylimino-3-[(2,4-dichlorophenyl)methyl]-5-octoxy-1,3-benzothiazol-6-yl]ethanamide

Systemtic Name: N-[2-butylimino-3-[(2,4-dichlorophenyl)methyl]-5-octoxy-1,3-benzothiazol-6-yl]ethanamide Openeye Name: N-[2-butylimino-3-[(2,4-dichlorophenyl)methyl]-5-octoxy-1,3-benzothiazol-6-yl]acetamide CAS Name: N-[2-butylimino-3-[(2,4-dichlorophenyl)methyl]-5-octoxy-1,3-benzothiazol-6-yl]acetamide IUPAC Name: N-[2-butylimino-3-[(2,4-dichlorophenyl)methyl]-5-octoxy-1,3-benzothiazol-6-yl]acetamide Traditional Name: N-[2-butylimino-3-(2,4-dichlorobenzyl)-5-octoxy-1,3-benzothiazol-6-yl]acetamide Formula: C28H37Cl2N3O2S MolecularWeight: 550.58328

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=C2C(=C1)N(C(=NCCCC)S2)CC3=C(C=C(C=C3)Cl)Cl)NC(=O)C

Isomeric SMILES

CCCCCCCCOC1=C(C=C2C(=C1)N(C(=NCCCC)S2)CC3=C(C=C(C=C3)Cl)Cl)NC(=O)C

InChI

InChI=1S/C28H37Cl2N3O2S/c1-4-6-8-9-10-11-15-35-26-18-25-27(17-24(26)32-20(3)34)36-28(31-14-7-5-2)33(25)19-21-12-13-22(29)16-23(21)30/h12-13,16-18H,4-11,14-15,19H2,1-3H3,(H,32,34)