methyl 4-azanyl-5-[(2S)-2-[bis(ethylsulfanyl)methyl]pyrrolidin-1-yl]carbonyl-2-methyl-pyrazole-3-carboxylate

Systemtic Name: methyl 4-azanyl-5-[(2S)-2-[bis(ethylsulfanyl)methyl]pyrrolidin-1-yl]carbonyl-2-methyl-pyrazole-3-carboxylate Openeye Name: methyl 4-amino-5-[(2S)-2-[bis(ethylsulfanyl)methyl]pyrrolidine-1-carbonyl]-2-methyl-pyrazole-3-carboxylate CAS Name: 4-amino-5-[[(2S)-2-[bis(ethylthio)methyl]-1-pyrrolidinyl]-oxomethyl]-2-methyl-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 4-amino-5-[(2S)-2-[bis(ethylsulfanyl)methyl]pyrrolidine-1-carbonyl]-2-methylpyrazole-3-carboxylate Traditional Name: 4-amino-5-[(2S)-2-[bis(ethylthio)methyl]pyrrolidine-1-carbonyl]-2-methyl-pyrazole-3-carboxylic acid methyl ester Formula: C16H26N4O3S2 MolecularWeight: 386.53264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC(C1CCCN1C(=O)C2=NN(C(=C2N)C(=O)OC)C)SCC

Isomeric SMILES

CCSC([C@@H]1CCCN1C(=O)C2=NN(C(=C2N)C(=O)OC)C)SCC

InChI

InChI=1S/C16H26N4O3S2/c1-5-24-16(25-6-2)10-8-7-9-20(10)14(21)12-11(17)13(15(22)23-4)19(3)18-12/h10,16H,5-9,17H2,1-4H3/t10-/m0/s1