N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-5-(2,2-dimethylpropanoylamino)-3-methyl-thiophene-2-carboxamide

Systemtic Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-5-(2,2-dimethylpropanoylamino)-3-methyl-thiophene-2-carboxamide Openeye Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-5-(2,2-dimethylpropanoylamino)-3-methyl-thiophene-2-carboxamide CAS Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-5-[(2,2-dimethyl-1-oxopropyl)amino]-3-methyl-2-thiophenecarboxamide IUPAC Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-5-(2,2-dimethylpropanoylamino)-3-methylthiophene-2-carboxamide Traditional Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-3-methyl-5-(pivaloylamino)thiophene-2-carboxamide Formula: C22H28N4O2S2 MolecularWeight: 444.61332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)NC(=O)C(C)(C)C)C(=O)NC(CCSC)C2=NC3=CC=CC=C3N2

Isomeric SMILES

CC1=C(SC(=C1)NC(=O)C(C)(C)C)C(=O)NC(CCSC)C2=NC3=CC=CC=C3N2

InChI

InChI=1S/C22H28N4O2S2/c1-13-12-17(26-21(28)22(2,3)4)30-18(13)20(27)25-16(10-11-29-5)19-23-14-8-6-7-9-15(14)24-19/h6-9,12,16H,10-11H2,1-5H3,(H,23,24)(H,25,27)(H,26,28)