4-[(4-chloranyl-3-methyl-phenoxy)methyl]-N-(4-methyl-1,3-benzothiazol-2-yl)thiophene-2-carboxamide

Systemtic Name: 4-[(4-chloranyl-3-methyl-phenoxy)methyl]-N-(4-methyl-1,3-benzothiazol-2-yl)thiophene-2-carboxamide Openeye Name: 4-[(4-chloro-3-methyl-phenoxy)methyl]-N-(4-methyl-1,3-benzothiazol-2-yl)thiophene-2-carboxamide CAS Name: 4-[(4-chloro-3-methylphenoxy)methyl]-N-(4-methyl-1,3-benzothiazol-2-yl)-2-thiophenecarboxamide IUPAC Name: 4-[(4-chloro-3-methylphenoxy)methyl]-N-(4-methyl-1,3-benzothiazol-2-yl)thiophene-2-carboxamide Traditional Name: 4-[(4-chloro-3-methyl-phenoxy)methyl]-N-(4-methyl-1,3-benzothiazol-2-yl)thiophene-2-carboxamide Formula: C21H17ClN2O2S2 MolecularWeight: 428.95488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C3=CC(=CS3)COC4=CC(=C(C=C4)Cl)C

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C3=CC(=CS3)COC4=CC(=C(C=C4)Cl)C

InChI

InChI=1S/C21H17ClN2O2S2/c1-12-4-3-5-17-19(12)23-21(28-17)24-20(25)18-9-14(11-27-18)10-26-15-6-7-16(22)13(2)8-15/h3-9,11H,10H2,1-2H3,(H,23,24,25)