N-[(4-methylphenyl)methyl]-N-[2-(4-phenylpiperazin-1-yl)carbonyl-1-benzothiophen-5-yl]methanesulfonamide

Systemtic Name: N-[(4-methylphenyl)methyl]-N-[2-(4-phenylpiperazin-1-yl)carbonyl-1-benzothiophen-5-yl]methanesulfonamide Openeye Name: N-[2-(4-phenylpiperazine-1-carbonyl)benzothiophen-5-yl]-N-(p-tolylmethyl)methanesulfonamide CAS Name: N-[(4-methylphenyl)methyl]-N-[2-[oxo-(4-phenyl-1-piperazinyl)methyl]-1-benzothiophen-5-yl]methanesulfonamide IUPAC Name: N-[(4-methylphenyl)methyl]-N-[2-(4-phenylpiperazine-1-carbonyl)-1-benzothiophen-5-yl]methanesulfonamide Traditional Name: N-(4-methylbenzyl)-N-[2-(4-phenylpiperazine-1-carbonyl)benzothiophen-5-yl]methanesulfonamide Formula: C28H29N3O3S2 MolecularWeight: 519.67816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(C2=CC3=C(C=C2)SC(=C3)C(=O)N4CCN(CC4)C5=CC=CC=C5)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)CN(C2=CC3=C(C=C2)SC(=C3)C(=O)N4CCN(CC4)C5=CC=CC=C5)S(=O)(=O)C

InChI

InChI=1S/C28H29N3O3S2/c1-21-8-10-22(11-9-21)20-31(36(2,33)34)25-12-13-26-23(18-25)19-27(35-26)28(32)30-16-14-29(15-17-30)24-6-4-3-5-7-24/h3-13,18-19H,14-17,20H2,1-2H3