3-chloranyl-N-[4-(3-methylbutanoylamino)phenyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[4-(3-methylbutanoylamino)phenyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[4-(3-methylbutanoylamino)phenyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[4-[(3-methyl-1-oxobutyl)amino]phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[4-(3-methylbutanoylamino)phenyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[4-(isovalerylamino)phenyl]benzothiophene-2-carboxamide Formula: C20H19ClN2O2S MolecularWeight: 386.89506

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)C2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C20H19ClN2O2S/c1-12(2)11-17(24)22-13-7-9-14(10-8-13)23-20(25)19-18(21)15-5-3-4-6-16(15)26-19/h3-10,12H,11H2,1-2H3,(H,22,24)(H,23,25)