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

Systemtic Name: 3-chloranyl-4-methyl-N-[[2-(3-methylphenyl)-1,3-thiazol-4-yl]methyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-4-methyl-N-[[2-(m-tolyl)thiazol-4-yl]methyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-4-methyl-N-[[2-(3-methylphenyl)-4-thiazolyl]methyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-4-methyl-N-[[2-(3-methylphenyl)-1,3-thiazol-4-yl]methyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-4-methyl-N-[[2-(m-tolyl)thiazol-4-yl]methyl]benzothiophene-2-carboxamide Formula: C21H17ClN2OS2 MolecularWeight: 412.95548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=C2Cl)C(=O)NCC3=CSC(=N3)C4=CC(=CC=C4)C

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=C2Cl)C(=O)NCC3=CSC(=N3)C4=CC(=CC=C4)C

InChI

InChI=1S/C21H17ClN2OS2/c1-12-5-3-7-14(9-12)21-24-15(11-26-21)10-23-20(25)19-18(22)17-13(2)6-4-8-16(17)27-19/h3-9,11H,10H2,1-2H3,(H,23,25)