propan-2-yl 4-[2-[(4-methylsulfonylphenyl)carbonylamino]-1,3-thiazol-5-yl]piperidine-1-carboxylate

Systemtic Name: propan-2-yl 4-[2-[(4-methylsulfonylphenyl)carbonylamino]-1,3-thiazol-5-yl]piperidine-1-carboxylate Openeye Name: isopropyl 4-[2-[(4-methylsulfonylbenzoyl)amino]thiazol-5-yl]piperidine-1-carboxylate CAS Name: 4-[2-[[(4-methylsulfonylphenyl)-oxomethyl]amino]-5-thiazolyl]-1-piperidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[2-[(4-methylsulfonylbenzoyl)amino]-1,3-thiazol-5-yl]piperidine-1-carboxylate Traditional Name: 4-[2-[(4-mesylbenzoyl)amino]thiazol-5-yl]piperidine-1-carboxylic acid isopropyl ester Formula: C20H25N3O5S2 MolecularWeight: 451.5596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)N1CCC(CC1)C2=CN=C(S2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC(C)OC(=O)N1CCC(CC1)C2=CN=C(S2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C20H25N3O5S2/c1-13(2)28-20(25)23-10-8-14(9-11-23)17-12-21-19(29-17)22-18(24)15-4-6-16(7-5-15)30(3,26)27/h4-7,12-14H,8-11H2,1-3H3,(H,21,22,24)