(E)-3-anthracen-9-yl-N-[5-[(4-butylphenyl)methyl]-1,3-thiazol-2-yl]-2-cyano-prop-2-enamide

Systemtic Name: (E)-3-anthracen-9-yl-N-[5-[(4-butylphenyl)methyl]-1,3-thiazol-2-yl]-2-cyano-prop-2-enamide Openeye Name: (E)-3-(9-anthryl)-N-[5-[(4-butylphenyl)methyl]thiazol-2-yl]-2-cyano-prop-2-enamide CAS Name: (E)-3-(9-anthracenyl)-N-[5-[(4-butylphenyl)methyl]-2-thiazolyl]-2-cyano-2-propenamide IUPAC Name: (E)-3-anthracen-9-yl-N-[5-[(4-butylphenyl)methyl]-1,3-thiazol-2-yl]-2-cyanoprop-2-enamide Traditional Name: (E)-3-(9-anthryl)-N-[5-(4-butylbenzyl)thiazol-2-yl]-2-cyano-acrylamide Formula: C32H27N3OS MolecularWeight: 501.64128

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)CC2=CN=C(S2)NC(=O)C(=CC3=C4C=CC=CC4=CC5=CC=CC=C53)C#N

Isomeric SMILES

CCCCC1=CC=C(C=C1)CC2=CN=C(S2)NC(=O)/C(=C/C3=C4C=CC=CC4=CC5=CC=CC=C53)/C#N

InChI

InChI=1S/C32H27N3OS/c1-2-3-8-22-13-15-23(16-14-22)17-27-21-34-32(37-27)35-31(36)26(20-33)19-30-28-11-6-4-9-24(28)18-25-10-5-7-12-29(25)30/h4-7,9-16,18-19,21H,2-3,8,17H2,1H3,(H,34,35,36)/b26-19+