tert-butyl 4-[4-[[3-(1H-imidazol-5-yl)-1-methoxy-1-oxidanylidene-propan-2-yl]carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[[3-(1H-imidazol-5-yl)-1-methoxy-1-oxidanylidene-propan-2-yl]carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-[[1-(1H-imidazol-5-ylmethyl)-2-methoxy-2-oxo-ethyl]carbamoyl]thiazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-[[[3-(1H-imidazol-5-yl)-1-methoxy-1-oxopropan-2-yl]amino]-oxomethyl]-2-thiazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[[3-(1H-imidazol-5-yl)-1-methoxy-1-oxopropan-2-yl]carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[4-[[1-(1H-imidazol-5-ylmethyl)-2-keto-2-methoxy-ethyl]carbamoyl]thiazol-2-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H29N5O5S MolecularWeight: 463.55046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C2=NC(=CS2)C(=O)NC(CC3=CN=CN3)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C2=NC(=CS2)C(=O)NC(CC3=CN=CN3)C(=O)OC

InChI

InChI=1S/C21H29N5O5S/c1-21(2,3)31-20(29)26-7-5-13(6-8-26)18-25-16(11-32-18)17(27)24-15(19(28)30-4)9-14-10-22-12-23-14/h10-13,15H,5-9H2,1-4H3,(H,22,23)(H,24,27)