N-[(2-chlorophenyl)methyl]-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]propanamide

Systemtic Name: N-[(2-chlorophenyl)methyl]-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]propanamide Openeye Name: N-[(2-chlorophenyl)methyl]-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]propanamide CAS Name: N-[(2-chlorophenyl)methyl]-2-[4-(4-methoxyphenyl)sulfonyl-1-piperazinyl]propanamide IUPAC Name: N-[(2-chlorophenyl)methyl]-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]propanamide Traditional Name: N-(2-chlorobenzyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazino]propionamide Formula: C21H26ClN3O4S MolecularWeight: 451.96684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1Cl)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C(=O)NCC1=CC=CC=C1Cl)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H26ClN3O4S/c1-16(21(26)23-15-17-5-3-4-6-20(17)22)24-11-13-25(14-12-24)30(27,28)19-9-7-18(29-2)8-10-19/h3-10,16H,11-15H2,1-2H3,(H,23,26)