N-[4-methyl-3-(3-methylbutanoylamino)phenyl]thiophene-2-carboxamide

Systemtic Name: N-[4-methyl-3-(3-methylbutanoylamino)phenyl]thiophene-2-carboxamide Openeye Name: N-[4-methyl-3-(3-methylbutanoylamino)phenyl]thiophene-2-carboxamide CAS Name: N-[4-methyl-3-[(3-methyl-1-oxobutyl)amino]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-methyl-3-(3-methylbutanoylamino)phenyl]thiophene-2-carboxamide Traditional Name: N-[3-(isovalerylamino)-4-methyl-phenyl]thiophene-2-carboxamide Formula: C17H20N2O2S MolecularWeight: 316.4179

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC=CS2)NC(=O)CC(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC=CS2)NC(=O)CC(C)C

InChI

InChI=1S/C17H20N2O2S/c1-11(2)9-16(20)19-14-10-13(7-6-12(14)3)18-17(21)15-5-4-8-22-15/h4-8,10-11H,9H2,1-3H3,(H,18,21)(H,19,20)