4,5-dimethyl-N-[2-(2-methylpropanoylamino)ethyl]-2-pyrrol-1-yl-thiophene-3-carboxamide

Systemtic Name: 4,5-dimethyl-N-[2-(2-methylpropanoylamino)ethyl]-2-pyrrol-1-yl-thiophene-3-carboxamide Openeye Name: 4,5-dimethyl-N-[2-(2-methylpropanoylamino)ethyl]-2-pyrrol-1-yl-thiophene-3-carboxamide CAS Name: 4,5-dimethyl-N-[2-[(2-methyl-1-oxopropyl)amino]ethyl]-2-(1-pyrrolyl)-3-thiophenecarboxamide IUPAC Name: 4,5-dimethyl-N-[2-(2-methylpropanoylamino)ethyl]-2-pyrrol-1-ylthiophene-3-carboxamide Traditional Name: N-[2-(isobutyrylamino)ethyl]-4,5-dimethyl-2-pyrrol-1-yl-thiophene-3-carboxamide Formula: C17H23N3O2S MolecularWeight: 333.44842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)NCCNC(=O)C(C)C)N2C=CC=C2)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)NCCNC(=O)C(C)C)N2C=CC=C2)C

InChI

InChI=1S/C17H23N3O2S/c1-11(2)15(21)18-7-8-19-16(22)14-12(3)13(4)23-17(14)20-9-5-6-10-20/h5-6,9-11H,7-8H2,1-4H3,(H,18,21)(H,19,22)