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

Systemtic Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-4,5-dimethyl-2-pyrrol-1-yl-thiophene-3-carboxamide Openeye Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-4,5-dimethyl-2-pyrrol-1-yl-thiophene-3-carboxamide CAS Name: N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-4,5-dimethyl-2-(1-pyrrolyl)-3-thiophenecarboxamide IUPAC Name: N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-4,5-dimethyl-2-pyrrol-1-ylthiophene-3-carboxamide Traditional Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-4,5-dimethyl-2-pyrrol-1-yl-thiophene-3-carboxamide Formula: C21H23N3O5S MolecularWeight: 429.48942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)NCCC2=CC(=C(C=C2[N+](=O)[O-])OC)OC)N3C=CC=C3)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)NCCC2=CC(=C(C=C2[N+](=O)[O-])OC)OC)N3C=CC=C3)C

InChI

InChI=1S/C21H23N3O5S/c1-13-14(2)30-21(23-9-5-6-10-23)19(13)20(25)22-8-7-15-11-17(28-3)18(29-4)12-16(15)24(26)27/h5-6,9-12H,7-8H2,1-4H3,(H,22,25)