N-(5-chloranyl-2-methoxy-phenyl)-2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]propanamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]propanamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-2-[4-(p-tolylsulfonyl)piperazin-1-yl]propanamide CAS Name: N-(5-chloro-2-methoxyphenyl)-2-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]propanamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]propanamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-2-(4-tosylpiperazino)propionamide Formula: C21H26ClN3O4S MolecularWeight: 451.96684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(C)C(=O)NC3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(C)C(=O)NC3=C(C=CC(=C3)Cl)OC

InChI

InChI=1S/C21H26ClN3O4S/c1-15-4-7-18(8-5-15)30(27,28)25-12-10-24(11-13-25)16(2)21(26)23-19-14-17(22)6-9-20(19)29-3/h4-9,14,16H,10-13H2,1-3H3,(H,23,26)