2-(1,3-benzothiazol-2-ylsulfanyl)-N-[4-(4-hexylphenyl)-1,3-thiazol-2-yl]-2-phenyl-ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[4-(4-hexylphenyl)-1,3-thiazol-2-yl]-2-phenyl-ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[4-(4-hexylphenyl)thiazol-2-yl]-2-phenyl-acetamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-[4-(4-hexylphenyl)-2-thiazolyl]-2-phenylacetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[4-(4-hexylphenyl)-1,3-thiazol-2-yl]-2-phenylacetamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-[4-(4-hexylphenyl)thiazol-2-yl]-2-phenyl-acetamide Formula: C30H29N3OS3 MolecularWeight: 543.76576

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C(C3=CC=CC=C3)SC4=NC5=CC=CC=C5S4

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C(C3=CC=CC=C3)SC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C30H29N3OS3/c1-2-3-4-6-11-21-16-18-22(19-17-21)25-20-35-29(31-25)33-28(34)27(23-12-7-5-8-13-23)37-30-32-24-14-9-10-15-26(24)36-30/h5,7-10,12-20,27H,2-4,6,11H2,1H3,(H,31,33,34)