N-[1-(3-benzamidophenyl)ethyl]-5-methyl-4-nitro-thiophene-2-carboxamide

Systemtic Name: N-[1-(3-benzamidophenyl)ethyl]-5-methyl-4-nitro-thiophene-2-carboxamide Openeye Name: N-[1-(3-benzamidophenyl)ethyl]-5-methyl-4-nitro-thiophene-2-carboxamide CAS Name: N-[1-(3-benzamidophenyl)ethyl]-5-methyl-4-nitro-2-thiophenecarboxamide IUPAC Name: N-[1-(3-benzamidophenyl)ethyl]-5-methyl-4-nitrothiophene-2-carboxamide Traditional Name: N-[1-(3-benzamidophenyl)ethyl]-5-methyl-4-nitro-thiophene-2-carboxamide Formula: C21H19N3O4S MolecularWeight: 409.45826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(S1)C(=O)NC(C)C2=CC(=CC=C2)NC(=O)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(S1)C(=O)NC(C)C2=CC(=CC=C2)NC(=O)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H19N3O4S/c1-13(22-21(26)19-12-18(24(27)28)14(2)29-19)16-9-6-10-17(11-16)23-20(25)15-7-4-3-5-8-15/h3-13H,1-2H3,(H,22,26)(H,23,25)