prop-2-ynyl 4-[4-[(6-fluoranyl-1,3-benzothiazol-2-yl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate

Systemtic Name: prop-2-ynyl 4-[4-[(6-fluoranyl-1,3-benzothiazol-2-yl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Openeye Name: prop-2-ynyl 4-[4-[(6-fluoro-1,3-benzothiazol-2-yl)carbamoyl]thiazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-[[(6-fluoro-1,3-benzothiazol-2-yl)amino]-oxomethyl]-2-thiazolyl]-1-piperidinecarboxylic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl 4-[4-[(6-fluoro-1,3-benzothiazol-2-yl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[4-[(6-fluoro-1,3-benzothiazol-2-yl)carbamoyl]thiazol-2-yl]piperidine-1-carboxylic acid propargyl ester Formula: C20H17FN4O3S2 MolecularWeight: 444.502383

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC(=O)N1CCC(CC1)C2=NC(=CS2)C(=O)NC3=NC4=C(S3)C=C(C=C4)F

Isomeric SMILES

C#CCOC(=O)N1CCC(CC1)C2=NC(=CS2)C(=O)NC3=NC4=C(S3)C=C(C=C4)F

InChI

InChI=1S/C20H17FN4O3S2/c1-2-9-28-20(27)25-7-5-12(6-8-25)18-22-15(11-29-18)17(26)24-19-23-14-4-3-13(21)10-16(14)30-19/h1,3-4,10-12H,5-9H2,(H,23,24,26)