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

Systemtic Name: N-[1-(3-benzamidophenyl)ethyl]-N,5-dimethyl-4-nitro-thiophene-2-carboxamide Openeye Name: N-[1-(3-benzamidophenyl)ethyl]-N,5-dimethyl-4-nitro-thiophene-2-carboxamide CAS Name: N-[1-(3-benzamidophenyl)ethyl]-N,5-dimethyl-4-nitro-2-thiophenecarboxamide IUPAC Name: N-[1-(3-benzamidophenyl)ethyl]-N,5-dimethyl-4-nitrothiophene-2-carboxamide Traditional Name: N-[1-(3-benzamidophenyl)ethyl]-N,5-dimethyl-4-nitro-thiophene-2-carboxamide Formula: C22H21N3O4S MolecularWeight: 423.48484

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21N3O4S/c1-14(24(3)22(27)20-13-19(25(28)29)15(2)30-20)17-10-7-11-18(12-17)23-21(26)16-8-5-4-6-9-16/h4-14H,1-3H3,(H,23,26)