3-chloranyl-N-[5-[(4-propan-2-ylphenyl)methyl]-1,3,4-oxadiazol-2-yl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[5-[(4-propan-2-ylphenyl)methyl]-1,3,4-oxadiazol-2-yl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[5-[(4-isopropylphenyl)methyl]-1,3,4-oxadiazol-2-yl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[5-[(4-propan-2-ylphenyl)methyl]-1,3,4-oxadiazol-2-yl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[5-[(4-propan-2-ylphenyl)methyl]-1,3,4-oxadiazol-2-yl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[5-(4-isopropylbenzyl)-1,3,4-oxadiazol-2-yl]benzothiophene-2-carboxamide Formula: C21H18ClN3O2S MolecularWeight: 411.90452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CC2=NN=C(O2)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CC2=NN=C(O2)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C21H18ClN3O2S/c1-12(2)14-9-7-13(8-10-14)11-17-24-25-21(27-17)23-20(26)19-18(22)15-5-3-4-6-16(15)28-19/h3-10,12H,11H2,1-2H3,(H,23,25,26)