2-methyl-7-[4-(phenylmethyl)piperidin-1-yl]sulfonyl-4H-1,4-benzothiazin-3-one

Systemtic Name: 2-methyl-7-[4-(phenylmethyl)piperidin-1-yl]sulfonyl-4H-1,4-benzothiazin-3-one Openeye Name: 7-[(4-benzyl-1-piperidyl)sulfonyl]-2-methyl-4H-1,4-benzothiazin-3-one CAS Name: 2-methyl-7-[[4-(phenylmethyl)-1-piperidinyl]sulfonyl]-4H-1,4-benzothiazin-3-one IUPAC Name: 7-(4-benzylpiperidin-1-yl)sulfonyl-2-methyl-4H-1,4-benzothiazin-3-one Traditional Name: 7-(4-benzylpiperidino)sulfonyl-2-methyl-4H-1,4-benzothiazin-3-one Formula: C21H24N2O3S2 MolecularWeight: 416.55686

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC2=C(S1)C=C(C=C2)S(=O)(=O)N3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1C(=O)NC2=C(S1)C=C(C=C2)S(=O)(=O)N3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C21H24N2O3S2/c1-15-21(24)22-19-8-7-18(14-20(19)27-15)28(25,26)23-11-9-17(10-12-23)13-16-5-3-2-4-6-16/h2-8,14-15,17H,9-13H2,1H3,(H,22,24)