ethyl 4-[2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)carbamoyl]pyrrolidin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxylate

Systemtic Name: ethyl 4-[2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)carbamoyl]pyrrolidin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxylate Openeye Name: ethyl 4-[2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)carbamoyl]pyrrolidin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxylate CAS Name: 4-[[2-[[[5-(ethylthio)-1,3,4-thiadiazol-2-yl]amino]-oxomethyl]-1-pyrrolidinyl]sulfonyl]-1-methyl-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)carbamoyl]pyrrolidin-1-yl]sulfonyl-1-methylpyrrole-2-carboxylate Traditional Name: 4-[2-[[5-(ethylthio)-1,3,4-thiadiazol-2-yl]carbamoyl]pyrrolidino]sulfonyl-1-methyl-pyrrole-2-carboxylic acid ethyl ester Formula: C17H23N5O5S3 MolecularWeight: 473.59002

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CN1C)S(=O)(=O)N2CCCC2C(=O)NC3=NN=C(S3)SCC

Isomeric SMILES

CCOC(=O)C1=CC(=CN1C)S(=O)(=O)N2CCCC2C(=O)NC3=NN=C(S3)SCC

InChI

InChI=1S/C17H23N5O5S3/c1-4-27-15(24)13-9-11(10-21(13)3)30(25,26)22-8-6-7-12(22)14(23)18-16-19-20-17(29-16)28-5-2/h9-10,12H,4-8H2,1-3H3,(H,18,19,23)