2,5-dimethyl-N-(2-phenylsulfanylethyl)-1-propan-2-yl-pyrrole-3-carboxamide

Systemtic Name: 2,5-dimethyl-N-(2-phenylsulfanylethyl)-1-propan-2-yl-pyrrole-3-carboxamide Openeye Name: 1-isopropyl-2,5-dimethyl-N-(2-phenylsulfanylethyl)pyrrole-3-carboxamide CAS Name: 2,5-dimethyl-N-[2-(phenylthio)ethyl]-1-propan-2-yl-3-pyrrolecarboxamide IUPAC Name: 2,5-dimethyl-N-(2-phenylsulfanylethyl)-1-propan-2-ylpyrrole-3-carboxamide Traditional Name: 1-isopropyl-2,5-dimethyl-N-[2-(phenylthio)ethyl]pyrrole-3-carboxamide Formula: C18H24N2OS MolecularWeight: 316.46096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C(C)C)C)C(=O)NCCSC2=CC=CC=C2

Isomeric SMILES

CC1=CC(=C(N1C(C)C)C)C(=O)NCCSC2=CC=CC=C2

InChI

InChI=1S/C18H24N2OS/c1-13(2)20-14(3)12-17(15(20)4)18(21)19-10-11-22-16-8-6-5-7-9-16/h5-9,12-13H,10-11H2,1-4H3,(H,19,21)