tert-butyl 4-[4-[(5-nitro-1,3-thiazol-2-yl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[(5-nitro-1,3-thiazol-2-yl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-[(5-nitrothiazol-2-yl)carbamoyl]thiazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-[[(5-nitro-2-thiazolyl)amino]-oxomethyl]-2-thiazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[(5-nitro-1,3-thiazol-2-yl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[4-[(5-nitrothiazol-2-yl)carbamoyl]thiazol-2-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C17H21N5O5S2 MolecularWeight: 439.50914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C2=NC(=CS2)C(=O)NC3=NC=C(S3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C2=NC(=CS2)C(=O)NC3=NC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C17H21N5O5S2/c1-17(2,3)27-16(24)21-6-4-10(5-7-21)14-19-11(9-28-14)13(23)20-15-18-8-12(29-15)22(25)26/h8-10H,4-7H2,1-3H3,(H,18,20,23)