4-tert-butyl-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]benzenecarbothioamide

Systemtic Name: 4-tert-butyl-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]benzenecarbothioamide Openeye Name: 4-tert-butyl-N-[3-(2-oxopyrrolidin-1-yl)propyl]benzenecarbothioamide CAS Name: 4-tert-butyl-N-[3-(2-oxo-1-pyrrolidinyl)propyl]benzenecarbothioamide IUPAC Name: 4-tert-butyl-N-[3-(2-oxopyrrolidin-1-yl)propyl]benzenecarbothioamide Traditional Name: 4-tert-butyl-N-[3-(2-ketopyrrolidino)propyl]thiobenzamide Formula: C18H26N2OS MolecularWeight: 318.47684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=S)NCCCN2CCCC2=O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=S)NCCCN2CCCC2=O

InChI

InChI=1S/C18H26N2OS/c1-18(2,3)15-9-7-14(8-10-15)17(22)19-11-5-13-20-12-4-6-16(20)21/h7-10H,4-6,11-13H2,1-3H3,(H,19,22)