2-[[6-[(4-bromophenyl)methylideneamino]-1,3-benzothiazol-2-yl]sulfanyl]-N-butyl-ethanamide

Systemtic Name: 2-[[6-[(4-bromophenyl)methylideneamino]-1,3-benzothiazol-2-yl]sulfanyl]-N-butyl-ethanamide Openeye Name: 2-[[6-[(4-bromophenyl)methyleneamino]-1,3-benzothiazol-2-yl]sulfanyl]-N-butyl-acetamide CAS Name: 2-[[6-[(4-bromophenyl)methylideneamino]-1,3-benzothiazol-2-yl]thio]-N-butylacetamide IUPAC Name: 2-[[6-[(4-bromophenyl)methylideneamino]-1,3-benzothiazol-2-yl]sulfanyl]-N-butylacetamide Traditional Name: 2-[[6-[(4-bromobenzylidene)amino]-1,3-benzothiazol-2-yl]thio]-N-butyl-acetamide Formula: C20H20BrN3OS2 MolecularWeight: 462.4263

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CSC1=NC2=C(S1)C=C(C=C2)N=CC3=CC=C(C=C3)Br

Isomeric SMILES

CCCCNC(=O)CSC1=NC2=C(S1)C=C(C=C2)N=CC3=CC=C(C=C3)Br

InChI

InChI=1S/C20H20BrN3OS2/c1-2-3-10-22-19(25)13-26-20-24-17-9-8-16(11-18(17)27-20)23-12-14-4-6-15(21)7-5-14/h4-9,11-12H,2-3,10,13H2,1H3,(H,22,25)