(3S)-1-tert-butyl-5-oxidanylidene-N-[5-(phenylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-3-carboxamide

Systemtic Name: (3S)-1-tert-butyl-5-oxidanylidene-N-[5-(phenylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-3-carboxamide Openeye Name: (3S)-1-tert-butyl-5-oxo-N-[5-(phenylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-3-carboxamide CAS Name: (3S)-1-tert-butyl-5-oxo-N-[5-[(phenylthio)methyl]-1,3,4-thiadiazol-2-yl]-3-pyrrolidinecarboxamide IUPAC Name: (3S)-1-tert-butyl-5-oxo-N-[5-(phenylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-3-carboxamide Traditional Name: (3S)-1-tert-butyl-5-keto-N-[5-[(phenylthio)methyl]-1,3,4-thiadiazol-2-yl]pyrrolidine-3-carboxamide Formula: C18H22N4O2S2 MolecularWeight: 390.52288

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1CC(CC1=O)C(=O)NC2=NN=C(S2)CSC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)N1C[C@H](CC1=O)C(=O)NC2=NN=C(S2)CSC3=CC=CC=C3

InChI

InChI=1S/C18H22N4O2S2/c1-18(2,3)22-10-12(9-15(22)23)16(24)19-17-21-20-14(26-17)11-25-13-7-5-4-6-8-13/h4-8,12H,9-11H2,1-3H3,(H,19,21,24)/t12-/m0/s1