(1E,3E)-1,3-bis(3-butyl-4,5-diphenyl-1,3-thiazol-2-ylidene)propan-2-one

Systemtic Name: (1E,3E)-1,3-bis(3-butyl-4,5-diphenyl-1,3-thiazol-2-ylidene)propan-2-one Openeye Name: (1E,3E)-1,3-bis(3-butyl-4,5-diphenyl-thiazol-2-ylidene)propan-2-one CAS Name: (1E,3E)-1,3-bis(3-butyl-4,5-diphenyl-2-thiazolylidene)-2-propanone IUPAC Name: (1E,3E)-1,3-bis(3-butyl-4,5-diphenyl-1,3-thiazol-2-ylidene)propan-2-one Traditional Name: (1E,3E)-1,3-bis(3-butyl-4,5-diphenyl-4-thiazolin-2-ylidene)acetone Formula: C41H40N2OS2 MolecularWeight: 640.8991

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CC(=O)C=C2N(C(=C(S2)C3=CC=CC=C3)C4=CC=CC=C4)CCCC)SC(=C1C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CCCCN\1C(=C(S/C1=C/C(=O)/C=C\2/SC(=C(N2CCCC)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C41H40N2OS2/c1-3-5-27-42-36(45-40(33-23-15-9-16-24-33)38(42)31-19-11-7-12-20-31)29-35(44)30-37-43(28-6-4-2)39(32-21-13-8-14-22-32)41(46-37)34-25-17-10-18-26-34/h7-26,29-30H,3-6,27-28H2,1-2H3/b36-29+,37-30+