4-[1-(6-chloranyl-4-phenyl-quinazolin-2-yl)-5-thiophen-2-yl-pyrazolidin-3-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[1-(6-chloranyl-4-phenyl-quinazolin-2-yl)-5-thiophen-2-yl-pyrazolidin-3-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[1-(6-chloro-4-phenyl-quinazolin-2-yl)-5-(2-thienyl)pyrazolidin-3-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[1-(6-chloro-4-phenyl-2-quinazolinyl)-5-thiophen-2-yl-3-pyrazolidinylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[1-(6-chloro-4-phenylquinazolin-2-yl)-5-thiophen-2-ylpyrazolidin-3-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[1-(6-chloro-4-phenyl-quinazolin-2-yl)-5-(2-thienyl)pyrazolidin-3-ylidene]cyclohexa-2,5-dien-1-one Formula: C27H19ClN4OS MolecularWeight: 482.98396

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(NC1=C2C=CC(=O)C=C2)C3=NC4=C(C=C(C=C4)Cl)C(=N3)C5=CC=CC=C5)C6=CC=CS6

Isomeric SMILES

C1C(N(NC1=C2C=CC(=O)C=C2)C3=NC4=C(C=C(C=C4)Cl)C(=N3)C5=CC=CC=C5)C6=CC=CS6

InChI

InChI=1S/C27H19ClN4OS/c28-19-10-13-22-21(15-19)26(18-5-2-1-3-6-18)30-27(29-22)32-24(25-7-4-14-34-25)16-23(31-32)17-8-11-20(33)12-9-17/h1-15,24,31H,16H2