N-[(3-methoxy-4-propan-2-yloxy-phenyl)methyl]-3-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzamide

Systemtic Name: N-[(3-methoxy-4-propan-2-yloxy-phenyl)methyl]-3-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzamide Openeye Name: N-[(4-isopropoxy-3-methoxy-phenyl)methyl]-3-[[4-(p-tolylsulfonyl)piperazin-1-yl]methyl]benzamide CAS Name: N-[(3-methoxy-4-propan-2-yloxyphenyl)methyl]-3-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methyl]benzamide IUPAC Name: N-[(3-methoxy-4-propan-2-yloxyphenyl)methyl]-3-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzamide Traditional Name: N-(4-isopropoxy-3-methoxy-benzyl)-3-[(4-tosylpiperazino)methyl]benzamide Formula: C30H37N3O5S MolecularWeight: 551.69688

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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(=C(C=C4)OC(C)C)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC(=C3)C(=O)NCC4=CC(=C(C=C4)OC(C)C)OC

InChI

InChI=1S/C30H37N3O5S/c1-22(2)38-28-13-10-24(19-29(28)37-4)20-31-30(34)26-7-5-6-25(18-26)21-32-14-16-33(17-15-32)39(35,36)27-11-8-23(3)9-12-27/h5-13,18-19,22H,14-17,20-21H2,1-4H3,(H,31,34)