5-(2,2-dimethylpropanoylamino)-3-methyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]thiophene-2-carboxamide

Systemtic Name: 5-(2,2-dimethylpropanoylamino)-3-methyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]thiophene-2-carboxamide Openeye Name: 5-(2,2-dimethylpropanoylamino)-3-methyl-N-[4-(3-pyridylmethylsulfanyl)phenyl]thiophene-2-carboxamide CAS Name: 5-[(2,2-dimethyl-1-oxopropyl)amino]-3-methyl-N-[4-(3-pyridinylmethylthio)phenyl]-2-thiophenecarboxamide IUPAC Name: 5-(2,2-dimethylpropanoylamino)-3-methyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]thiophene-2-carboxamide Traditional Name: 3-methyl-5-(pivaloylamino)-N-[4-(3-pyridylmethylthio)phenyl]thiophene-2-carboxamide Formula: C23H25N3O2S2 MolecularWeight: 439.5935

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)NC(=O)C(C)(C)C)C(=O)NC2=CC=C(C=C2)SCC3=CN=CC=C3

Isomeric SMILES

CC1=C(SC(=C1)NC(=O)C(C)(C)C)C(=O)NC2=CC=C(C=C2)SCC3=CN=CC=C3

InChI

InChI=1S/C23H25N3O2S2/c1-15-12-19(26-22(28)23(2,3)4)30-20(15)21(27)25-17-7-9-18(10-8-17)29-14-16-6-5-11-24-13-16/h5-13H,14H2,1-4H3,(H,25,27)(H,26,28)