N-[[5-[4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]sulfonylthiophen-2-yl]methyl]-4-chloranyl-benzamide

Systemtic Name: N-[[5-[4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]sulfonylthiophen-2-yl]methyl]-4-chloranyl-benzamide Openeye Name: N-[[5-[4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]sulfonyl-2-thienyl]methyl]-4-chloro-benzamide CAS Name: N-[[5-[[4-[(4-tert-butylphenyl)methyl]-1-piperazinyl]sulfonyl]-2-thiophenyl]methyl]-4-chlorobenzamide IUPAC Name: N-[[5-[4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]sulfonylthiophen-2-yl]methyl]-4-chlorobenzamide Traditional Name: N-[[5-[4-(4-tert-butylbenzyl)piperazino]sulfonyl-2-thienyl]methyl]-4-chloro-benzamide Formula: C27H32ClN3O3S2 MolecularWeight: 546.14428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2CCN(CC2)S(=O)(=O)C3=CC=C(S3)CNC(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2CCN(CC2)S(=O)(=O)C3=CC=C(S3)CNC(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C27H32ClN3O3S2/c1-27(2,3)22-8-4-20(5-9-22)19-30-14-16-31(17-15-30)36(33,34)25-13-12-24(35-25)18-29-26(32)21-6-10-23(28)11-7-21/h4-13H,14-19H2,1-3H3,(H,29,32)