1-methyl-N-[3-(2-phenylsulfanyl-1H-imidazol-5-yl)propyl]pyrrole-2-carboxamide

Systemtic Name: 1-methyl-N-[3-(2-phenylsulfanyl-1H-imidazol-5-yl)propyl]pyrrole-2-carboxamide Openeye Name: 1-methyl-N-[3-(2-phenylsulfanyl-1H-imidazol-5-yl)propyl]pyrrole-2-carboxamide CAS Name: 1-methyl-N-[3-[2-(phenylthio)-1H-imidazol-5-yl]propyl]-2-pyrrolecarboxamide IUPAC Name: 1-methyl-N-[3-(2-phenylsulfanyl-1H-imidazol-5-yl)propyl]pyrrole-2-carboxamide Traditional Name: 1-methyl-N-[3-[2-(phenylthio)-1H-imidazol-5-yl]propyl]pyrrole-2-carboxamide Formula: C18H20N4OS MolecularWeight: 340.4426

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(=O)NCCCC2=CN=C(N2)SC3=CC=CC=C3

Isomeric SMILES

CN1C=CC=C1C(=O)NCCCC2=CN=C(N2)SC3=CC=CC=C3

InChI

InChI=1S/C18H20N4OS/c1-22-12-6-10-16(22)17(23)19-11-5-7-14-13-20-18(21-14)24-15-8-3-2-4-9-15/h2-4,6,8-10,12-13H,5,7,11H2,1H3,(H,19,23)(H,20,21)