N-[(2-methoxyphenyl)methyl]-3-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzamide

Systemtic Name: N-[(2-methoxyphenyl)methyl]-3-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzamide Openeye Name: N-[(2-methoxyphenyl)methyl]-3-[[4-(p-tolylsulfonyl)piperazin-1-yl]methyl]benzamide CAS Name: N-[(2-methoxyphenyl)methyl]-3-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methyl]benzamide IUPAC Name: N-[(2-methoxyphenyl)methyl]-3-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzamide Traditional Name: N-o-anisyl-3-[(4-tosylpiperazino)methyl]benzamide Formula: C27H31N3O4S MolecularWeight: 493.61774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC(=C3)C(=O)NCC4=CC=CC=C4OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC(=C3)C(=O)NCC4=CC=CC=C4OC

InChI

InChI=1S/C27H31N3O4S/c1-21-10-12-25(13-11-21)35(32,33)30-16-14-29(15-17-30)20-22-6-5-8-23(18-22)27(31)28-19-24-7-3-4-9-26(24)34-2/h3-13,18H,14-17,19-20H2,1-2H3,(H,28,31)