6-[bis[4-(diethylamino)-2-methyl-phenyl]methyl]-N,N-diethyl-5-methyl-1,3-benzothiazol-2-amine

Systemtic Name: 6-[bis[4-(diethylamino)-2-methyl-phenyl]methyl]-N,N-diethyl-5-methyl-1,3-benzothiazol-2-amine Openeye Name: 6-[bis[4-(diethylamino)-2-methyl-phenyl]methyl]-N,N-diethyl-5-methyl-1,3-benzothiazol-2-amine CAS Name: 6-[bis[4-(diethylamino)-2-methylphenyl]methyl]-N,N-diethyl-5-methyl-1,3-benzothiazol-2-amine IUPAC Name: 6-[bis[4-(diethylamino)-2-methylphenyl]methyl]-N,N-diethyl-5-methyl-1,3-benzothiazol-2-amine Traditional Name: [6-[bis[4-(diethylamino)-2-methyl-phenyl]methyl]-5-methyl-1,3-benzothiazol-2-yl]-diethyl-amine Formula: C35H48N4S MolecularWeight: 556.84742

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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=CC4=C(C=C3C)N=C(S4)N(CC)CC)C

Isomeric SMILES

CCN(CC)C1=CC(=C(C=C1)C(C2=C(C=C(C=C2)N(CC)CC)C)C3=CC4=C(C=C3C)N=C(S4)N(CC)CC)C

InChI

InChI=1S/C35H48N4S/c1-10-37(11-2)27-16-18-29(24(7)20-27)34(30-19-17-28(21-25(30)8)38(12-3)13-4)31-23-33-32(22-26(31)9)36-35(40-33)39(14-5)15-6/h16-23,34H,10-15H2,1-9H3