2-[2-[cyclobutylcarbonyl-(phenylmethyl)amino]ethanoylamino]-4,5-dimethyl-thiophene-3-carboxamide

Systemtic Name: 2-[2-[cyclobutylcarbonyl-(phenylmethyl)amino]ethanoylamino]-4,5-dimethyl-thiophene-3-carboxamide Openeye Name: 2-[[2-[benzyl(cyclobutanecarbonyl)amino]acetyl]amino]-4,5-dimethyl-thiophene-3-carboxamide CAS Name: 2-[[2-[[cyclobutyl(oxo)methyl]-(phenylmethyl)amino]-1-oxoethyl]amino]-4,5-dimethyl-3-thiophenecarboxamide IUPAC Name: 2-[[2-[benzyl(cyclobutanecarbonyl)amino]acetyl]amino]-4,5-dimethylthiophene-3-carboxamide Traditional Name: 2-[[2-[benzyl(cyclobutanecarbonyl)amino]acetyl]amino]-4,5-dimethyl-thiophene-3-carboxamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N)NC(=O)CN(CC2=CC=CC=C2)C(=O)C3CCC3)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)N)NC(=O)CN(CC2=CC=CC=C2)C(=O)C3CCC3)C

InChI

InChI=1S/C21H25N3O3S/c1-13-14(2)28-20(18(13)19(22)26)23-17(25)12-24(21(27)16-9-6-10-16)11-15-7-4-3-5-8-15/h3-5,7-8,16H,6,9-12H2,1-2H3,(H2,22,26)(H,23,25)