prop-2-enyl 2-(4-methylpiperazin-1-yl)carbonyl-4-sulfanyl-pyrrolidine-1-carboxylate

Systemtic Name: prop-2-enyl 2-(4-methylpiperazin-1-yl)carbonyl-4-sulfanyl-pyrrolidine-1-carboxylate Openeye Name: allyl 2-(4-methylpiperazine-1-carbonyl)-4-sulfanyl-pyrrolidine-1-carboxylate CAS Name: 4-mercapto-2-[(4-methyl-1-piperazinyl)-oxomethyl]-1-pyrrolidinecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 2-(4-methylpiperazine-1-carbonyl)-4-sulfanylpyrrolidine-1-carboxylate Traditional Name: 4-mercapto-2-(4-methylpiperazine-1-carbonyl)pyrrolidine-1-carboxylic acid allyl ester Formula: C14H23N3O3S MolecularWeight: 313.41572

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2CC(CN2C(=O)OCC=C)S

Isomeric SMILES

CN1CCN(CC1)C(=O)C2CC(CN2C(=O)OCC=C)S

InChI

InChI=1S/C14H23N3O3S/c1-3-8-20-14(19)17-10-11(21)9-12(17)13(18)16-6-4-15(2)5-7-16/h3,11-12,21H,1,4-10H2,2H3