prop-2-enyl 4-[3-[(2S,4S)-1-prop-2-enoxycarbonyl-4-sulfanyl-pyrrolidin-2-yl]prop-2-enoyl]piperazine-1-carboxylate

Systemtic Name: prop-2-enyl 4-[3-[(2S,4S)-1-prop-2-enoxycarbonyl-4-sulfanyl-pyrrolidin-2-yl]prop-2-enoyl]piperazine-1-carboxylate Openeye Name: allyl 4-[3-[(2S,4S)-1-allyloxycarbonyl-4-sulfanyl-pyrrolidin-2-yl]prop-2-enoyl]piperazine-1-carboxylate CAS Name: 4-[3-[(2S,4S)-4-mercapto-1-[oxo(prop-2-enoxy)methyl]-2-pyrrolidinyl]-1-oxoprop-2-enyl]-1-piperazinecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 4-[3-[(2S,4S)-1-prop-2-enoxycarbonyl-4-sulfanylpyrrolidin-2-yl]prop-2-enoyl]piperazine-1-carboxylate Traditional Name: 4-[3-[(2S,4S)-1-allyloxycarbonyl-4-mercapto-pyrrolidin-2-yl]acryloyl]piperazine-1-carboxylic acid allyl ester Formula: C19H27N3O5S MolecularWeight: 409.49978

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)N1CCN(CC1)C(=O)C=CC2CC(CN2C(=O)OCC=C)S

Isomeric SMILES

C=CCOC(=O)N1CCN(CC1)C(=O)C=C[C@@H]2C[C@@H](CN2C(=O)OCC=C)S

InChI

InChI=1S/C19H27N3O5S/c1-3-11-26-18(24)21-9-7-20(8-10-21)17(23)6-5-15-13-16(28)14-22(15)19(25)27-12-4-2/h3-6,15-16,28H,1-2,7-14H2/t15-,16+/m1/s1