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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H19ClN2OS2/c1-22(2,3)14-10-8-13(9-11-14)16-12-27-21(24-16)25-20(26)19-18(23)15-6-4-5-7-17(15)28-19/h4-12H,1-3H3,(H,24,25,26)