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

Systemtic Name: 5-[[2,5-bis(chloranyl)phenyl]carbonylamino]-4-cyano-N,N-diethyl-3-methyl-thiophene-2-carboxamide Openeye Name: 4-cyano-5-[(2,5-dichlorobenzoyl)amino]-N,N-diethyl-3-methyl-thiophene-2-carboxamide CAS Name: 4-cyano-5-[[(2,5-dichlorophenyl)-oxomethyl]amino]-N,N-diethyl-3-methyl-2-thiophenecarboxamide IUPAC Name: 4-cyano-5-[(2,5-dichlorobenzoyl)amino]-N,N-diethyl-3-methylthiophene-2-carboxamide Traditional Name: 4-cyano-5-[(2,5-dichlorobenzoyl)amino]-N,N-diethyl-3-methyl-thiophene-2-carboxamide Formula: C18H17Cl2N3O2S MolecularWeight: 410.31748

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=C(C=CC(=C2)Cl)Cl)C#N)C

Isomeric SMILES

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=C(C=CC(=C2)Cl)Cl)C#N)C

InChI

InChI=1S/C18H17Cl2N3O2S/c1-4-23(5-2)18(25)15-10(3)13(9-21)17(26-15)22-16(24)12-8-11(19)6-7-14(12)20/h6-8H,4-5H2,1-3H3,(H,22,24)