N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)-4-phenyl-N-(2-thiophen-2-ylethyl)benzamide

Systemtic Name: N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)-4-phenyl-N-(2-thiophen-2-ylethyl)benzamide Openeye Name: N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)-4-phenyl-N-[2-(2-thienyl)ethyl]benzamide CAS Name: N-[4-(methylthio)-1,3-benzothiazol-2-yl]-4-phenyl-N-(2-thiophen-2-ylethyl)benzamide IUPAC Name: N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)-4-phenyl-N-(2-thiophen-2-ylethyl)benzamide Traditional Name: N-[4-(methylthio)-1,3-benzothiazol-2-yl]-4-phenyl-N-[2-(2-thienyl)ethyl]benzamide Formula: C27H22N2OS3 MolecularWeight: 486.67138

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC2=C1N=C(S2)N(CCC3=CC=CS3)C(=O)C4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

CSC1=CC=CC2=C1N=C(S2)N(CCC3=CC=CS3)C(=O)C4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H22N2OS3/c1-31-23-10-5-11-24-25(23)28-27(33-24)29(17-16-22-9-6-18-32-22)26(30)21-14-12-20(13-15-21)19-7-3-2-4-8-19/h2-15,18H,16-17H2,1H3