5-methyl-N-[[4-[methyl(propan-2-yl)carbamoyl]phenyl]methyl]-4-nitro-thiophene-2-carboxamide

Systemtic Name: 5-methyl-N-[[4-[methyl(propan-2-yl)carbamoyl]phenyl]methyl]-4-nitro-thiophene-2-carboxamide Openeye Name: N-[[4-[isopropyl(methyl)carbamoyl]phenyl]methyl]-5-methyl-4-nitro-thiophene-2-carboxamide CAS Name: 5-methyl-N-[[4-[[methyl(propan-2-yl)amino]-oxomethyl]phenyl]methyl]-4-nitro-2-thiophenecarboxamide IUPAC Name: 5-methyl-N-[[4-[methyl(propan-2-yl)carbamoyl]phenyl]methyl]-4-nitrothiophene-2-carboxamide Traditional Name: N-[4-[isopropyl(methyl)carbamoyl]benzyl]-5-methyl-4-nitro-thiophene-2-carboxamide Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(S1)C(=O)NCC2=CC=C(C=C2)C(=O)N(C)C(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(S1)C(=O)NCC2=CC=C(C=C2)C(=O)N(C)C(C)C)[N+](=O)[O-]

InChI

InChI=1S/C18H21N3O4S/c1-11(2)20(4)18(23)14-7-5-13(6-8-14)10-19-17(22)16-9-15(21(24)25)12(3)26-16/h5-9,11H,10H2,1-4H3,(H,19,22)