N-[(2S)-1-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]furan-2-carboxamide

Systemtic Name: N-[(2S)-1-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]furan-2-carboxamide Openeye Name: N-[(1S)-1-[4-(2,4-dimethylphenyl)sulfonylpiperazine-1-carbonyl]-2-methyl-propyl]furan-2-carboxamide CAS Name: N-[(2S)-1-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]-3-methyl-1-oxobutan-2-yl]-2-furancarboxamide IUPAC Name: N-[(2S)-1-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-3-methyl-1-oxobutan-2-yl]furan-2-carboxamide Traditional Name: N-[(1S)-1-[4-(2,4-dimethylphenyl)sulfonylpiperazine-1-carbonyl]-2-methyl-propyl]-2-furamide Formula: C22H29N3O5S MolecularWeight: 447.54776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C(C(C)C)NC(=O)C3=CC=CO3)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)[C@H](C(C)C)NC(=O)C3=CC=CO3)C

InChI

InChI=1S/C22H29N3O5S/c1-15(2)20(23-21(26)18-6-5-13-30-18)22(27)24-9-11-25(12-10-24)31(28,29)19-8-7-16(3)14-17(19)4/h5-8,13-15,20H,9-12H2,1-4H3,(H,23,26)/t20-/m0/s1