(2E)-2-[7-(diethylamino)-4-methyl-chromen-2-ylidene]-1-phenyl-2-phenylsulfanyl-ethanone

Systemtic Name: (2E)-2-[7-(diethylamino)-4-methyl-chromen-2-ylidene]-1-phenyl-2-phenylsulfanyl-ethanone Openeye Name: (2E)-2-[7-(diethylamino)-4-methyl-chromen-2-ylidene]-1-phenyl-2-phenylsulfanyl-ethanone CAS Name: (2E)-2-[7-(diethylamino)-4-methyl-1-benzopyran-2-ylidene]-1-phenyl-2-(phenylthio)ethanone IUPAC Name: (2E)-2-[7-(diethylamino)-4-methylchromen-2-ylidene]-1-phenyl-2-phenylsulfanylethanone Traditional Name: (2E)-2-[7-(diethylamino)-4-methyl-chromen-2-ylidene]-1-phenyl-2-(phenylthio)ethanone Formula: C28H27NO2S MolecularWeight: 441.58448

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)C(=CC(=C(C(=O)C3=CC=CC=C3)SC4=CC=CC=C4)O2)C

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)C(=C/C(=C(/C(=O)C3=CC=CC=C3)\SC4=CC=CC=C4)/O2)C

InChI

InChI=1S/C28H27NO2S/c1-4-29(5-2)22-16-17-24-20(3)18-26(31-25(24)19-22)28(32-23-14-10-7-11-15-23)27(30)21-12-8-6-9-13-21/h6-19H,4-5H2,1-3H3/b28-26+