2-(butylamino)-5-[(4-chlorophenyl)methyl]-4-oxidanylidene-N-phenyl-thiophene-3-carboxamide

Systemtic Name: 2-(butylamino)-5-[(4-chlorophenyl)methyl]-4-oxidanylidene-N-phenyl-thiophene-3-carboxamide Openeye Name: 2-(butylamino)-5-[(4-chlorophenyl)methyl]-4-oxo-N-phenyl-thiophene-3-carboxamide CAS Name: 2-(butylamino)-5-[(4-chlorophenyl)methyl]-4-oxo-N-phenyl-3-thiophenecarboxamide IUPAC Name: 2-(butylamino)-5-[(4-chlorophenyl)methyl]-4-oxo-N-phenylthiophene-3-carboxamide Traditional Name: 2-(butylamino)-5-(4-chlorobenzyl)-4-keto-N-phenyl-thiophene-3-carboxamide Formula: C22H23ClN2O2S MolecularWeight: 414.94822

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C(=O)C(S1)CC2=CC=C(C=C2)Cl)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CCCCNC1=C(C(=O)C(S1)CC2=CC=C(C=C2)Cl)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H23ClN2O2S/c1-2-3-13-24-22-19(21(27)25-17-7-5-4-6-8-17)20(26)18(28-22)14-15-9-11-16(23)12-10-15/h4-12,18,24H,2-3,13-14H2,1H3,(H,25,27)