4-[(E)-[2-morpholin-4-yl-3-(phenylcarbamothioyl)cyclopent-2-en-1-ylidene]methyl]benzoate

Systemtic Name: 4-[(E)-[2-morpholin-4-yl-3-(phenylcarbamothioyl)cyclopent-2-en-1-ylidene]methyl]benzoate Openeye Name: 4-[(E)-[2-morpholino-3-(phenylcarbamothioyl)cyclopent-2-en-1-ylidene]methyl]benzoate CAS Name: 4-[(E)-[3-[anilino(sulfanylidene)methyl]-2-(4-morpholinyl)-1-cyclopent-2-enylidene]methyl]benzoate IUPAC Name: 4-[(E)-[2-morpholin-4-yl-3-(phenylcarbamothioyl)cyclopent-2-en-1-ylidene]methyl]benzoate Traditional Name: 4-[(E)-[2-morpholino-3-(phenylthiocarbamoyl)cyclopent-2-en-1-ylidene]methyl]benzoate Formula: C24H23N2O3S- MolecularWeight: 419.51602

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C(C1=CC2=CC=C(C=C2)C(=O)[O-])N3CCOCC3)C(=S)NC4=CC=CC=C4

Isomeric SMILES

C\1CC(=C(/C1=C/C2=CC=C(C=C2)C(=O)[O-])N3CCOCC3)C(=S)NC4=CC=CC=C4

InChI

InChI=1S/C24H24N2O3S/c27-24(28)18-8-6-17(7-9-18)16-19-10-11-21(22(19)26-12-14-29-15-13-26)23(30)25-20-4-2-1-3-5-20/h1-9,16H,10-15H2,(H,25,30)(H,27,28)/p-1/b19-16+