N-[2-(4-chloranylphenoxy)ethyl]-N-methyl-3-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-benzamide

Systemtic Name: N-[2-(4-chloranylphenoxy)ethyl]-N-methyl-3-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-benzamide Openeye Name: 3-(4-benzylpiperazin-1-yl)sulfonyl-N-[2-(4-chlorophenoxy)ethyl]-N-methyl-benzamide CAS Name: N-[2-(4-chlorophenoxy)ethyl]-N-methyl-3-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]benzamide IUPAC Name: 3-(4-benzylpiperazin-1-yl)sulfonyl-N-[2-(4-chlorophenoxy)ethyl]-N-methylbenzamide Traditional Name: 3-(4-benzylpiperazino)sulfonyl-N-[2-(4-chlorophenoxy)ethyl]-N-methyl-benzamide Formula: C27H30ClN3O4S MolecularWeight: 528.0628

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCOC1=CC=C(C=C1)Cl)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CN(CCOC1=CC=C(C=C1)Cl)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C27H30ClN3O4S/c1-29(18-19-35-25-12-10-24(28)11-13-25)27(32)23-8-5-9-26(20-23)36(33,34)31-16-14-30(15-17-31)21-22-6-3-2-4-7-22/h2-13,20H,14-19,21H2,1H3