[4-[[di(propan-2-yl)amino]methyl]phenyl]-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methanone

Systemtic Name: [4-[[di(propan-2-yl)amino]methyl]phenyl]-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methanone Openeye Name: [4-[(diisopropylamino)methyl]phenyl]-[4-(2-naphthylsulfonyl)piperazin-1-yl]methanone CAS Name: [4-[[di(propan-2-yl)amino]methyl]phenyl]-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]methanone IUPAC Name: [4-[[di(propan-2-yl)amino]methyl]phenyl]-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methanone Traditional Name: [4-[(diisopropylamino)methyl]phenyl]-[4-(2-naphthylsulfonyl)piperazino]methanone Formula: C28H35N3O3S MolecularWeight: 493.6608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)C(C)C

Isomeric SMILES

CC(C)N(CC1=CC=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)C(C)C

InChI

InChI=1S/C28H35N3O3S/c1-21(2)31(22(3)4)20-23-9-11-25(12-10-23)28(32)29-15-17-30(18-16-29)35(33,34)27-14-13-24-7-5-6-8-26(24)19-27/h5-14,19,21-22H,15-18,20H2,1-4H3