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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H19ClN2OS2/c1-3-13(2)14-8-10-15(11-9-14)17-12-27-22(24-17)25-21(26)20-19(23)16-6-4-5-7-18(16)28-20/h4-13H,3H2,1-2H3,(H,24,25,26)