(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-3-yl)-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: (2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-3-yl)-(4-phenylpiperazin-1-yl)methanone Openeye Name: (2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-3-yl)-(4-phenylpiperazin-1-yl)methanone CAS Name: (2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-3-yl)-(4-phenyl-1-piperazinyl)methanone IUPAC Name: (2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-3-yl)-(4-phenylpiperazin-1-yl)methanone Traditional Name: (2-mesyl-3,4-dihydro-1H-isoquinolin-3-yl)-(4-phenylpiperazino)methanone Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CC2=CC=CC=C2CC1C(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)N1CC2=CC=CC=C2CC1C(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C21H25N3O3S/c1-28(26,27)24-16-18-8-6-5-7-17(18)15-20(24)21(25)23-13-11-22(12-14-23)19-9-3-2-4-10-19/h2-10,20H,11-16H2,1H3