[4-(4-methylpiperazin-1-yl)-1-benzothiophen-2-yl]methyl 4-(2,3-dimethylphenyl)piperazine-1-carboxylate

Systemtic Name: [4-(4-methylpiperazin-1-yl)-1-benzothiophen-2-yl]methyl 4-(2,3-dimethylphenyl)piperazine-1-carboxylate Openeye Name: [4-(4-methylpiperazin-1-yl)benzothiophen-2-yl]methyl 4-(2,3-dimethylphenyl)piperazine-1-carboxylate CAS Name: 4-(2,3-dimethylphenyl)-1-piperazinecarboxylic acid [4-(4-methyl-1-piperazinyl)-1-benzothiophen-2-yl]methyl ester IUPAC Name: [4-(4-methylpiperazin-1-yl)-1-benzothiophen-2-yl]methyl 4-(2,3-dimethylphenyl)piperazine-1-carboxylate Traditional Name: 4-(2,3-dimethylphenyl)piperazine-1-carboxylic acid [4-(4-methylpiperazino)benzothiophen-2-yl]methyl ester Formula: C27H34N4O2S MolecularWeight: 478.64946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)OCC3=CC4=C(C=CC=C4S3)N5CCN(CC5)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)OCC3=CC4=C(C=CC=C4S3)N5CCN(CC5)C)C

InChI

InChI=1S/C27H34N4O2S/c1-20-6-4-7-24(21(20)2)29-14-16-31(17-15-29)27(32)33-19-22-18-23-25(8-5-9-26(23)34-22)30-12-10-28(3)11-13-30/h4-9,18H,10-17,19H2,1-3H3