[(3R)-3-methyl-4-[4-(2H-1,2,3-triazol-4-yl)phenyl]sulfonyl-piperazin-1-yl]-phenyl-methanone

Systemtic Name: [(3R)-3-methyl-4-[4-(2H-1,2,3-triazol-4-yl)phenyl]sulfonyl-piperazin-1-yl]-phenyl-methanone Openeye Name: [(3R)-3-methyl-4-[4-(2H-triazol-4-yl)phenyl]sulfonyl-piperazin-1-yl]-phenyl-methanone CAS Name: [(3R)-3-methyl-4-[4-(2H-triazol-4-yl)phenyl]sulfonyl-1-piperazinyl]-phenylmethanone IUPAC Name: [(3R)-3-methyl-4-[4-(2H-triazol-4-yl)phenyl]sulfonylpiperazin-1-yl]-phenylmethanone Traditional Name: [(3R)-3-methyl-4-[4-(2H-triazol-4-yl)phenyl]sulfonyl-piperazino]-phenyl-methanone Formula: C20H21N5O3S MolecularWeight: 411.47744

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1S(=O)(=O)C2=CC=C(C=C2)C3=NNN=C3)C(=O)C4=CC=CC=C4

Isomeric SMILES

C[C@@H]1CN(CCN1S(=O)(=O)C2=CC=C(C=C2)C3=NNN=C3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H21N5O3S/c1-15-14-24(20(26)17-5-3-2-4-6-17)11-12-25(15)29(27,28)18-9-7-16(8-10-18)19-13-21-23-22-19/h2-10,13,15H,11-12,14H2,1H3,(H,21,22,23)/t15-/m1/s1