2-[1-[3-(4-chlorophenyl)-2-oxidanyl-5-thiophen-2-yl-cyclohexa-2,5-dien-1-yl]ethylidene]propanediamide

Systemtic Name: 2-[1-[3-(4-chlorophenyl)-2-oxidanyl-5-thiophen-2-yl-cyclohexa-2,5-dien-1-yl]ethylidene]propanediamide Openeye Name: 2-[1-[3-(4-chlorophenyl)-2-hydroxy-5-(2-thienyl)cyclohexa-2,5-dien-1-yl]ethylidene]propanediamide CAS Name: 2-[1-[3-(4-chlorophenyl)-2-hydroxy-5-thiophen-2-yl-1-cyclohexa-2,5-dienyl]ethylidene]propanediamide IUPAC Name: 2-[1-[3-(4-chlorophenyl)-2-hydroxy-5-thiophen-2-ylcyclohexa-2,5-dien-1-yl]ethylidene]propanediamide Traditional Name: 2-[1-[3-(4-chlorophenyl)-2-hydroxy-5-(2-thienyl)cyclohexa-2,5-dien-1-yl]ethylidene]malonamide Formula: C21H19ClN2O3S MolecularWeight: 414.90516

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C(=O)N)C(=O)N)C1C=C(CC(=C1O)C2=CC=C(C=C2)Cl)C3=CC=CS3

Isomeric SMILES

CC(=C(C(=O)N)C(=O)N)C1C=C(CC(=C1O)C2=CC=C(C=C2)Cl)C3=CC=CS3

InChI

InChI=1S/C21H19ClN2O3S/c1-11(18(20(23)26)21(24)27)15-9-13(17-3-2-8-28-17)10-16(19(15)25)12-4-6-14(22)7-5-12/h2-9,15,25H,10H2,1H3,(H2,23,26)(H2,24,27)