4-[(4-methylsulfonylpiperazin-1-yl)methyl]-N-(2,2,7-trimethyl-3,4-dihydrochromen-4-yl)benzamide

Systemtic Name: 4-[(4-methylsulfonylpiperazin-1-yl)methyl]-N-(2,2,7-trimethyl-3,4-dihydrochromen-4-yl)benzamide Openeye Name: 4-[(4-methylsulfonylpiperazin-1-yl)methyl]-N-(2,2,7-trimethylchroman-4-yl)benzamide CAS Name: 4-[(4-methylsulfonyl-1-piperazinyl)methyl]-N-(2,2,7-trimethyl-3,4-dihydro-2H-1-benzopyran-4-yl)benzamide IUPAC Name: 4-[(4-methylsulfonylpiperazin-1-yl)methyl]-N-(2,2,7-trimethyl-3,4-dihydrochromen-4-yl)benzamide Traditional Name: 4-[(4-mesylpiperazino)methyl]-N-(2,2,7-trimethylchroman-4-yl)benzamide Formula: C25H33N3O4S MolecularWeight: 471.61222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(CC(O2)(C)C)NC(=O)C3=CC=C(C=C3)CN4CCN(CC4)S(=O)(=O)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(CC(O2)(C)C)NC(=O)C3=CC=C(C=C3)CN4CCN(CC4)S(=O)(=O)C

InChI

InChI=1S/C25H33N3O4S/c1-18-5-10-21-22(16-25(2,3)32-23(21)15-18)26-24(29)20-8-6-19(7-9-20)17-27-11-13-28(14-12-27)33(4,30)31/h5-10,15,22H,11-14,16-17H2,1-4H3,(H,26,29)