4-[bis[4-(diethylamino)-2-methyl-phenyl]-[tris[4-(diethylamino)-2-methyl-phenyl]methyldisulfanyl]methyl]-N,N-diethyl-3-methyl-aniline

Systemtic Name: 4-[bis[4-(diethylamino)-2-methyl-phenyl]-[tris[4-(diethylamino)-2-methyl-phenyl]methyldisulfanyl]methyl]-N,N-diethyl-3-methyl-aniline Openeye Name: 4-[bis[4-(diethylamino)-2-methyl-phenyl]-[tris[4-(diethylamino)-2-methyl-phenyl]methyldisulfanyl]methyl]-N,N-diethyl-3-methyl-aniline CAS Name: 4-[bis[4-(diethylamino)-2-methylphenyl]-[tris[4-(diethylamino)-2-methylphenyl]methyldisulfanyl]methyl]-N,N-diethyl-3-methylaniline IUPAC Name: 4-[bis[4-(diethylamino)-2-methylphenyl]-[tris[4-(diethylamino)-2-methylphenyl]methyldisulfanyl]methyl]-N,N-diethyl-3-methylaniline Traditional Name: [4-[bis[4-(diethylamino)-2-methyl-phenyl]-[tris[4-(diethylamino)-2-methyl-phenyl]methyldisulfanyl]methyl]-3-methyl-phenyl]-diethyl-amine Formula: C68H96N6S2 MolecularWeight: 1061.66004

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C=C1)C(C2=C(C=C(C=C2)N(CC)CC)C)(C3=C(C=C(C=C3)N(CC)CC)C)SSC(C4=C(C=C(C=C4)N(CC)CC)C)(C5=C(C=C(C=C5)N(CC)CC)C)C6=C(C=C(C=C6)N(CC)CC)C)C

Isomeric SMILES

CCN(CC)C1=CC(=C(C=C1)C(C2=C(C=C(C=C2)N(CC)CC)C)(C3=C(C=C(C=C3)N(CC)CC)C)SSC(C4=C(C=C(C=C4)N(CC)CC)C)(C5=C(C=C(C=C5)N(CC)CC)C)C6=C(C=C(C=C6)N(CC)CC)C)C

InChI

InChI=1S/C68H96N6S2/c1-19-69(20-2)55-31-37-61(49(13)43-55)67(62-38-32-56(44-50(62)14)70(21-3)22-4,63-39-33-57(45-51(63)15)71(23-5)24-6)75-76-68(64-40-34-58(46-52(64)16)72(25-7)26-8,65-41-35-59(47-53(65)17)73(27-9)28-10)66-42-36-60(48-54(66)18)74(29-11)30-12/h31-48H,19-30H2,1-18H3