N-(7-methoxy-2,2-dimethyl-3,4-dihydrochromen-4-yl)-3-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzamide

Systemtic Name: N-(7-methoxy-2,2-dimethyl-3,4-dihydrochromen-4-yl)-3-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzamide Openeye Name: N-(7-methoxy-2,2-dimethyl-chroman-4-yl)-3-[[4-(p-tolylsulfonyl)piperazin-1-yl]methyl]benzamide CAS Name: N-(7-methoxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl)-3-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methyl]benzamide IUPAC Name: N-(7-methoxy-2,2-dimethyl-3,4-dihydrochromen-4-yl)-3-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzamide Traditional Name: N-(7-methoxy-2,2-dimethyl-chroman-4-yl)-3-[(4-tosylpiperazino)methyl]benzamide Formula: C31H37N3O5S MolecularWeight: 563.70758

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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)NC4CC(OC5=C4C=CC(=C5)OC)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC(=C3)C(=O)NC4CC(OC5=C4C=CC(=C5)OC)(C)C

InChI

InChI=1S/C31H37N3O5S/c1-22-8-11-26(12-9-22)40(36,37)34-16-14-33(15-17-34)21-23-6-5-7-24(18-23)30(35)32-28-20-31(2,3)39-29-19-25(38-4)10-13-27(28)29/h5-13,18-19,28H,14-17,20-21H2,1-4H3,(H,32,35)