2-methylsulfanyl-3-phenyl-N-[3-(pyrimidin-2-ylamino)propyl]imidazole-4-carboxamide

Systemtic Name: 2-methylsulfanyl-3-phenyl-N-[3-(pyrimidin-2-ylamino)propyl]imidazole-4-carboxamide Openeye Name: 2-methylsulfanyl-3-phenyl-N-[3-(pyrimidin-2-ylamino)propyl]imidazole-4-carboxamide CAS Name: 2-(methylthio)-3-phenyl-N-[3-(2-pyrimidinylamino)propyl]-4-imidazolecarboxamide IUPAC Name: 2-methylsulfanyl-3-phenyl-N-[3-(pyrimidin-2-ylamino)propyl]imidazole-4-carboxamide Traditional Name: 2-(methylthio)-3-phenyl-N-[3-(2-pyrimidylamino)propyl]imidazole-4-carboxamide Formula: C18H20N6OS MolecularWeight: 368.456

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(N1C2=CC=CC=C2)C(=O)NCCCNC3=NC=CC=N3

Isomeric SMILES

CSC1=NC=C(N1C2=CC=CC=C2)C(=O)NCCCNC3=NC=CC=N3

InChI

InChI=1S/C18H20N6OS/c1-26-18-23-13-15(24(18)14-7-3-2-4-8-14)16(25)19-9-5-10-20-17-21-11-6-12-22-17/h2-4,6-8,11-13H,5,9-10H2,1H3,(H,19,25)(H,20,21,22)