(2R)-N-(3-fluoranyl-4-methyl-phenyl)-2-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]propanamide

Systemtic Name: (2R)-N-(3-fluoranyl-4-methyl-phenyl)-2-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]propanamide Openeye Name: (2R)-N-(3-fluoro-4-methyl-phenyl)-2-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]propanamide CAS Name: (2R)-N-(3-fluoro-4-methylphenyl)-2-[4-(4-methoxy-3-nitrophenyl)sulfonyl-1-piperazinyl]propanamide IUPAC Name: (2R)-N-(3-fluoro-4-methylphenyl)-2-[4-(4-methoxy-3-nitrophenyl)sulfonylpiperazin-1-yl]propanamide Traditional Name: (2R)-N-(3-fluoro-4-methyl-phenyl)-2-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazino]propionamide Formula: C21H25FN4O6S MolecularWeight: 480.509803

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-])F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)[C@@H](C)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-])F

InChI

InChI=1S/C21H25FN4O6S/c1-14-4-5-16(12-18(14)22)23-21(27)15(2)24-8-10-25(11-9-24)33(30,31)17-6-7-20(32-3)19(13-17)26(28)29/h4-7,12-13,15H,8-11H2,1-3H3,(H,23,27)/t15-/m1/s1