N-methanoylmethanamide; 1-[4-methyl-3-(phenylmethylsulfanyl)-2H-imidazol-1-yl]ethanone

Systemtic Name: N-methanoylmethanamide; 1-[4-methyl-3-(phenylmethylsulfanyl)-2H-imidazol-1-yl]ethanone Openeye Name: 1-(3-benzylsulfanyl-4-methyl-2H-imidazol-1-yl)ethanone; N-formylformamide CAS Name: N-formylformamide; 1-[4-methyl-3-(phenylmethylthio)-2H-imidazol-1-yl]ethanone IUPAC Name: 1-(3-benzylsulfanyl-4-methyl-2H-imidazol-1-yl)ethanone; N-formylformamide Traditional Name: 1-[3-(benzylthio)-4-methyl-4-imidazolin-1-yl]ethanone; N-formylformamide Formula: C15H19N3O3S MolecularWeight: 321.39466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(CN1SCC2=CC=CC=C2)C(=O)C.C(=O)NC=O

Isomeric SMILES

CC1=CN(CN1SCC2=CC=CC=C2)C(=O)C.C(=O)NC=O

InChI

InChI=1S/C13H16N2OS.C2H3NO2/c1-11-8-14(12(2)16)10-15(11)17-9-13-6-4-3-5-7-13;4-1-3-2-5/h3-8H,9-10H2,1-2H3;1-2H,(H,3,4,5)