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

Systemtic Name: 2-[[6-[(4-bromophenyl)methylideneamino]-1,3-benzothiazol-2-yl]sulfanyl]-N-cyclohexyl-ethanamide Openeye Name: 2-[[6-[(4-bromophenyl)methyleneamino]-1,3-benzothiazol-2-yl]sulfanyl]-N-cyclohexyl-acetamide CAS Name: 2-[[6-[(4-bromophenyl)methylideneamino]-1,3-benzothiazol-2-yl]thio]-N-cyclohexylacetamide IUPAC Name: 2-[[6-[(4-bromophenyl)methylideneamino]-1,3-benzothiazol-2-yl]sulfanyl]-N-cyclohexylacetamide Traditional Name: 2-[[6-[(4-bromobenzylidene)amino]-1,3-benzothiazol-2-yl]thio]-N-cyclohexyl-acetamide Formula: C22H22BrN3OS2 MolecularWeight: 488.46358

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)CSC2=NC3=C(S2)C=C(C=C3)N=CC4=CC=C(C=C4)Br

Isomeric SMILES

C1CCC(CC1)NC(=O)CSC2=NC3=C(S2)C=C(C=C3)N=CC4=CC=C(C=C4)Br

InChI

InChI=1S/C22H22BrN3OS2/c23-16-8-6-15(7-9-16)13-24-18-10-11-19-20(12-18)29-22(26-19)28-14-21(27)25-17-4-2-1-3-5-17/h6-13,17H,1-5,14H2,(H,25,27)