prop-2-ynyl 4-[4-[(5-methoxycarbonyl-1-methyl-pyrrol-3-yl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate

Systemtic Name: prop-2-ynyl 4-[4-[(5-methoxycarbonyl-1-methyl-pyrrol-3-yl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Openeye Name: prop-2-ynyl 4-[4-[(5-methoxycarbonyl-1-methyl-pyrrol-3-yl)carbamoyl]thiazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-[[(5-methoxycarbonyl-1-methyl-3-pyrrolyl)amino]-oxomethyl]-2-thiazolyl]-1-piperidinecarboxylic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl 4-[4-[(5-methoxycarbonyl-1-methylpyrrol-3-yl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[4-[(5-carbomethoxy-1-methyl-pyrrol-3-yl)carbamoyl]thiazol-2-yl]piperidine-1-carboxylic acid propargyl ester Formula: C20H22N4O5S MolecularWeight: 430.47748

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)OC)NC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)OCC#C

Isomeric SMILES

CN1C=C(C=C1C(=O)OC)NC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)OCC#C

InChI

InChI=1S/C20H22N4O5S/c1-4-9-29-20(27)24-7-5-13(6-8-24)18-22-15(12-30-18)17(25)21-14-10-16(19(26)28-3)23(2)11-14/h1,10-13H,5-9H2,2-3H3,(H,21,25)