4-cyano-N,N-diethyl-3-methyl-5-[(3-nitrophenyl)carbonylamino]thiophene-2-carboxamide

Systemtic Name: 4-cyano-N,N-diethyl-3-methyl-5-[(3-nitrophenyl)carbonylamino]thiophene-2-carboxamide Openeye Name: 4-cyano-N,N-diethyl-3-methyl-5-[(3-nitrobenzoyl)amino]thiophene-2-carboxamide CAS Name: 4-cyano-N,N-diethyl-3-methyl-5-[[(3-nitrophenyl)-oxomethyl]amino]-2-thiophenecarboxamide IUPAC Name: 4-cyano-N,N-diethyl-3-methyl-5-[(3-nitrobenzoyl)amino]thiophene-2-carboxamide Traditional Name: 4-cyano-N,N-diethyl-3-methyl-5-[(3-nitrobenzoyl)amino]thiophene-2-carboxamide Formula: C18H18N4O4S MolecularWeight: 386.42492

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C#N)C

Isomeric SMILES

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C#N)C

InChI

InChI=1S/C18H18N4O4S/c1-4-21(5-2)18(24)15-11(3)14(10-19)17(27-15)20-16(23)12-7-6-8-13(9-12)22(25)26/h6-9H,4-5H2,1-3H3,(H,20,23)