4-[1-benzothiophen-2-yl-[4-(diethylamino)-2-methyl-phenyl]methyl]-N,N-diethyl-3-methyl-aniline

Systemtic Name: 4-[1-benzothiophen-2-yl-[4-(diethylamino)-2-methyl-phenyl]methyl]-N,N-diethyl-3-methyl-aniline Openeye Name: 4-[benzothiophen-2-yl-[4-(diethylamino)-2-methyl-phenyl]methyl]-N,N-diethyl-3-methyl-aniline CAS Name: 4-[1-benzothiophen-2-yl-[4-(diethylamino)-2-methylphenyl]methyl]-N,N-diethyl-3-methylaniline IUPAC Name: 4-[1-benzothiophen-2-yl-[4-(diethylamino)-2-methylphenyl]methyl]-N,N-diethyl-3-methylaniline Traditional Name: [4-[benzothiophen-2-yl-[4-(diethylamino)-2-methyl-phenyl]methyl]-3-methyl-phenyl]-diethyl-amine Formula: C31H38N2S MolecularWeight: 470.71182

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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=CC=CC=C4S3)C

Isomeric SMILES

CCN(CC)C1=CC(=C(C=C1)C(C2=C(C=C(C=C2)N(CC)CC)C)C3=CC4=CC=CC=C4S3)C

InChI

InChI=1S/C31H38N2S/c1-7-32(8-2)25-15-17-27(22(5)19-25)31(30-21-24-13-11-12-14-29(24)34-30)28-18-16-26(20-23(28)6)33(9-3)10-4/h11-21,31H,7-10H2,1-6H3