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

Systemtic Name: prop-2-ynyl 4-[4-[(1-methylbenzimidazol-2-yl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Openeye Name: prop-2-ynyl 4-[4-[(1-methylbenzimidazol-2-yl)carbamoyl]thiazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-[[(1-methyl-2-benzimidazolyl)amino]-oxomethyl]-2-thiazolyl]-1-piperidinecarboxylic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl 4-[4-[(1-methylbenzimidazol-2-yl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[4-[(1-methylbenzimidazol-2-yl)carbamoyl]thiazol-2-yl]piperidine-1-carboxylic acid propargyl ester Formula: C21H21N5O3S MolecularWeight: 423.48814

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1NC(=O)C3=CSC(=N3)C4CCN(CC4)C(=O)OCC#C

Isomeric SMILES

CN1C2=CC=CC=C2N=C1NC(=O)C3=CSC(=N3)C4CCN(CC4)C(=O)OCC#C

InChI

InChI=1S/C21H21N5O3S/c1-3-12-29-21(28)26-10-8-14(9-11-26)19-22-16(13-30-19)18(27)24-20-23-15-6-4-5-7-17(15)25(20)2/h1,4-7,13-14H,8-12H2,2H3,(H,23,24,27)