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

Systemtic Name: prop-2-ynyl 4-[4-[(4-methoxycarbonyl-2-methyl-phenyl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Openeye Name: prop-2-ynyl 4-[4-[(4-methoxycarbonyl-2-methyl-phenyl)carbamoyl]thiazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-[(4-methoxycarbonyl-2-methylanilino)-oxomethyl]-2-thiazolyl]-1-piperidinecarboxylic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl 4-[4-[(4-methoxycarbonyl-2-methylphenyl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[4-[(4-carbomethoxy-2-methyl-phenyl)carbamoyl]thiazol-2-yl]piperidine-1-carboxylic acid propargyl ester Formula: C22H23N3O5S MolecularWeight: 441.50012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OC)NC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)OCC#C

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OC)NC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)OCC#C

InChI

InChI=1S/C22H23N3O5S/c1-4-11-30-22(28)25-9-7-15(8-10-25)20-24-18(13-31-20)19(26)23-17-6-5-16(12-14(17)2)21(27)29-3/h1,5-6,12-13,15H,7-11H2,2-3H3,(H,23,26)