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

Systemtic Name: 3-chloranyl-N-[4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[4-(4-isobutylphenyl)thiazol-2-yl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[4-[4-(2-methylpropyl)phenyl]-2-thiazolyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[4-(4-isobutylphenyl)thiazol-2-yl]benzothiophene-2-carboxamide Formula: C22H19ClN2OS2 MolecularWeight: 426.98206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H19ClN2OS2/c1-13(2)11-14-7-9-15(10-8-14)17-12-27-22(24-17)25-21(26)20-19(23)16-5-3-4-6-18(16)28-20/h3-10,12-13H,11H2,1-2H3,(H,24,25,26)