(E)-1-naphthalen-2-yl-3-[(3Z)-3-(piperidin-1-ylmethylidene)-2-pyrimidin-2-ylsulfanyl-cyclopenten-1-yl]prop-2-en-1-one

Systemtic Name: (E)-1-naphthalen-2-yl-3-[(3Z)-3-(piperidin-1-ylmethylidene)-2-pyrimidin-2-ylsulfanyl-cyclopenten-1-yl]prop-2-en-1-one Openeye Name: (E)-1-(2-naphthyl)-3-[(3Z)-3-(1-piperidylmethylene)-2-pyrimidin-2-ylsulfanyl-cyclopenten-1-yl]prop-2-en-1-one CAS Name: (E)-1-(2-naphthalenyl)-3-[(3Z)-3-(1-piperidinylmethylidene)-2-(2-pyrimidinylthio)-1-cyclopentenyl]-2-propen-1-one IUPAC Name: (E)-1-naphthalen-2-yl-3-[(3Z)-3-(piperidin-1-ylmethylidene)-2-pyrimidin-2-ylsulfanylcyclopenten-1-yl]prop-2-en-1-one Traditional Name: (E)-1-(2-naphthyl)-3-[(3Z)-3-(piperidinomethylene)-2-(2-pyrimidylthio)cyclopenten-1-yl]prop-2-en-1-one Formula: C28H27N3OS MolecularWeight: 453.59848

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C=C2CCC(=C2SC3=NC=CC=N3)C=CC(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CCN(CC1)/C=C\2/CCC(=C2SC3=NC=CC=N3)/C=C/C(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C28H27N3OS/c32-26(24-11-9-21-7-2-3-8-23(21)19-24)14-13-22-10-12-25(20-31-17-4-1-5-18-31)27(22)33-28-29-15-6-16-30-28/h2-3,6-9,11,13-16,19-20H,1,4-5,10,12,17-18H2/b14-13+,25-20-