1-(furan-2-ylmethyl)-2,5-dimethyl-N-(3-phenylsulfanylpropyl)pyrrole-3-carboxamide

Systemtic Name: 1-(furan-2-ylmethyl)-2,5-dimethyl-N-(3-phenylsulfanylpropyl)pyrrole-3-carboxamide Openeye Name: 1-(2-furylmethyl)-2,5-dimethyl-N-(3-phenylsulfanylpropyl)pyrrole-3-carboxamide CAS Name: 1-(2-furanylmethyl)-2,5-dimethyl-N-[3-(phenylthio)propyl]-3-pyrrolecarboxamide IUPAC Name: 1-(furan-2-ylmethyl)-2,5-dimethyl-N-(3-phenylsulfanylpropyl)pyrrole-3-carboxamide Traditional Name: 1-(2-furfuryl)-2,5-dimethyl-N-[3-(phenylthio)propyl]pyrrole-3-carboxamide Formula: C21H24N2O2S MolecularWeight: 368.49246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC=CO2)C)C(=O)NCCCSC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(N1CC2=CC=CO2)C)C(=O)NCCCSC3=CC=CC=C3

InChI

InChI=1S/C21H24N2O2S/c1-16-14-20(17(2)23(16)15-18-8-6-12-25-18)21(24)22-11-7-13-26-19-9-4-3-5-10-19/h3-6,8-10,12,14H,7,11,13,15H2,1-2H3,(H,22,24)