3-chloranyl-N-[4-(4-methylphenyl)-5-phenyl-1,3-thiazol-2-yl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[4-(4-methylphenyl)-5-phenyl-1,3-thiazol-2-yl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[5-phenyl-4-(p-tolyl)thiazol-2-yl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[4-(4-methylphenyl)-5-phenyl-2-thiazolyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[4-(4-methylphenyl)-5-phenyl-1,3-thiazol-2-yl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[5-phenyl-4-(p-tolyl)thiazol-2-yl]benzothiophene-2-carboxamide Formula: C25H17ClN2OS2 MolecularWeight: 460.99828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)C3=C(C4=CC=CC=C4S3)Cl)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)C3=C(C4=CC=CC=C4S3)Cl)C5=CC=CC=C5

InChI

InChI=1S/C25H17ClN2OS2/c1-15-11-13-16(14-12-15)21-22(17-7-3-2-4-8-17)31-25(27-21)28-24(29)23-20(26)18-9-5-6-10-19(18)30-23/h2-14H,1H3,(H,27,28,29)