[(3R)-3-methyl-4-(5-quinolin-2-ylthiophen-2-yl)sulfonyl-piperazin-1-yl]-phenyl-methanone

Systemtic Name: [(3R)-3-methyl-4-(5-quinolin-2-ylthiophen-2-yl)sulfonyl-piperazin-1-yl]-phenyl-methanone Openeye Name: [(3R)-3-methyl-4-[[5-(2-quinolyl)-2-thienyl]sulfonyl]piperazin-1-yl]-phenyl-methanone CAS Name: [(3R)-3-methyl-4-[[5-(2-quinolinyl)-2-thiophenyl]sulfonyl]-1-piperazinyl]-phenylmethanone IUPAC Name: [(3R)-3-methyl-4-(5-quinolin-2-ylthiophen-2-yl)sulfonylpiperazin-1-yl]-phenylmethanone Traditional Name: [(3R)-3-methyl-4-[[5-(2-quinolyl)-2-thienyl]sulfonyl]piperazino]-phenyl-methanone Formula: C25H23N3O3S2 MolecularWeight: 477.59842

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1S(=O)(=O)C2=CC=C(S2)C3=NC4=CC=CC=C4C=C3)C(=O)C5=CC=CC=C5

Isomeric SMILES

C[C@@H]1CN(CCN1S(=O)(=O)C2=CC=C(S2)C3=NC4=CC=CC=C4C=C3)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C25H23N3O3S2/c1-18-17-27(25(29)20-8-3-2-4-9-20)15-16-28(18)33(30,31)24-14-13-23(32-24)22-12-11-19-7-5-6-10-21(19)26-22/h2-14,18H,15-17H2,1H3/t18-/m1/s1