5-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-4-(4-methylphenyl)sulfonyl-2-propylsulfonyl-1,3-thiazole

Systemtic Name: 5-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-4-(4-methylphenyl)sulfonyl-2-propylsulfonyl-1,3-thiazole Openeye Name: 5-[(3S,5S)-3,5-dimethyl-1-piperidyl]-2-propylsulfonyl-4-(p-tolylsulfonyl)thiazole CAS Name: 5-[(3S,5S)-3,5-dimethyl-1-piperidinyl]-4-(4-methylphenyl)sulfonyl-2-propylsulfonylthiazole IUPAC Name: 5-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-4-(4-methylphenyl)sulfonyl-2-propylsulfonyl-1,3-thiazole Traditional Name: 5-[(3S,5S)-3,5-dimethylpiperidino]-2-propylsulfonyl-4-tosyl-thiazole Formula: C20H28N2O4S3 MolecularWeight: 456.64232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)C1=NC(=C(S1)N2CC(CC(C2)C)C)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCS(=O)(=O)C1=NC(=C(S1)N2C[C@H](C[C@@H](C2)C)C)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C20H28N2O4S3/c1-5-10-28(23,24)20-21-18(29(25,26)17-8-6-14(2)7-9-17)19(27-20)22-12-15(3)11-16(4)13-22/h6-9,15-16H,5,10-13H2,1-4H3/t15-,16-/m0/s1