(3E,5E)-3,5-bis[[4-(diethylamino)-2-methyl-phenyl]methylidene]thian-4-one

Systemtic Name: (3E,5E)-3,5-bis[[4-(diethylamino)-2-methyl-phenyl]methylidene]thian-4-one Openeye Name: (3E,5E)-3,5-bis[[4-(diethylamino)-2-methyl-phenyl]methylene]tetrahydrothiopyran-4-one CAS Name: (3E,5E)-3,5-bis[[4-(diethylamino)-2-methylphenyl]methylidene]-4-thianone IUPAC Name: (3E,5E)-3,5-bis[[4-(diethylamino)-2-methylphenyl]methylidene]thian-4-one Traditional Name: (3E,5E)-3,5-bis[4-(diethylamino)-2-methyl-benzylidene]tetrahydrothiopyran-4-one Formula: C29H38N2OS MolecularWeight: 462.68982

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C=C1)C=C2CSCC(=CC3=C(C=C(C=C3)N(CC)CC)C)C2=O)C

Isomeric SMILES

CCN(C1=CC(=C(C=C1)/C=C/2\C(=O)/C(=C\C3=C(C=C(C=C3)N(CC)CC)C)/CSC2)C)CC

InChI

InChI=1S/C29H38N2OS/c1-7-30(8-2)27-13-11-23(21(5)15-27)17-25-19-33-20-26(29(25)32)18-24-12-14-28(16-22(24)6)31(9-3)10-4/h11-18H,7-10,19-20H2,1-6H3/b25-17-,26-18-