N-(2,6-diethylphenyl)-2-[[6-[(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methylamino]-1,3-benzothiazol-2-yl]sulfanyl]ethanamide

Systemtic Name: N-(2,6-diethylphenyl)-2-[[6-[(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methylamino]-1,3-benzothiazol-2-yl]sulfanyl]ethanamide Openeye Name: N-(2,6-diethylphenyl)-2-[[6-[(6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-1,3-benzothiazol-2-yl]sulfanyl]acetamide CAS Name: N-(2,6-diethylphenyl)-2-[[6-[(6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-1,3-benzothiazol-2-yl]thio]acetamide IUPAC Name: N-(2,6-diethylphenyl)-2-[[6-[(6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-1,3-benzothiazol-2-yl]sulfanyl]acetamide Traditional Name: N-(2,6-diethylphenyl)-2-[[6-[(6-ketocyclohexa-2,4-dien-1-ylidene)methylamino]-1,3-benzothiazol-2-yl]thio]acetamide Formula: C26H25N3O2S2 MolecularWeight: 475.6256

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)CSC2=NC3=C(S2)C=C(C=C3)NC=C4C=CC=CC4=O

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)CSC2=NC3=C(S2)C=C(C=C3)NC=C4C=CC=CC4=O

InChI

InChI=1S/C26H25N3O2S2/c1-3-17-9-7-10-18(4-2)25(17)29-24(31)16-32-26-28-21-13-12-20(14-23(21)33-26)27-15-19-8-5-6-11-22(19)30/h5-15,27H,3-4,16H2,1-2H3,(H,29,31)