[4-(phenylmethyl)sulfonylpiperazin-1-yl]-quinolin-2-yl-methanone

Systemtic Name: [4-(phenylmethyl)sulfonylpiperazin-1-yl]-quinolin-2-yl-methanone Openeye Name: (4-benzylsulfonylpiperazin-1-yl)-(2-quinolyl)methanone CAS Name: [4-(phenylmethyl)sulfonyl-1-piperazinyl]-(2-quinolinyl)methanone IUPAC Name: (4-benzylsulfonylpiperazin-1-yl)-quinolin-2-ylmethanone Traditional Name: (4-benzylsulfonylpiperazino)-(2-quinolyl)methanone Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=NC3=CC=CC=C3C=C2)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)C2=NC3=CC=CC=C3C=C2)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C21H21N3O3S/c25-21(20-11-10-18-8-4-5-9-19(18)22-20)23-12-14-24(15-13-23)28(26,27)16-17-6-2-1-3-7-17/h1-11H,12-16H2