5-methyl-2-[2-(4-nitrophenyl)sulfanylethanoylamino]-4-phenyl-thiophene-3-carboxamide

Systemtic Name: 5-methyl-2-[2-(4-nitrophenyl)sulfanylethanoylamino]-4-phenyl-thiophene-3-carboxamide Openeye Name: 5-methyl-2-[[2-(4-nitrophenyl)sulfanylacetyl]amino]-4-phenyl-thiophene-3-carboxamide CAS Name: 5-methyl-2-[[2-[(4-nitrophenyl)thio]-1-oxoethyl]amino]-4-phenyl-3-thiophenecarboxamide IUPAC Name: 5-methyl-2-[[2-(4-nitrophenyl)sulfanylacetyl]amino]-4-phenylthiophene-3-carboxamide Traditional Name: 5-methyl-2-[[2-[(4-nitrophenyl)thio]acetyl]amino]-4-phenyl-thiophene-3-carboxamide Formula: C20H17N3O4S2 MolecularWeight: 427.49668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)CSC2=CC=C(C=C2)[N+](=O)[O-])C(=O)N)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)CSC2=CC=C(C=C2)[N+](=O)[O-])C(=O)N)C3=CC=CC=C3

InChI

InChI=1S/C20H17N3O4S2/c1-12-17(13-5-3-2-4-6-13)18(19(21)25)20(29-12)22-16(24)11-28-15-9-7-14(8-10-15)23(26)27/h2-10H,11H2,1H3,(H2,21,25)(H,22,24)