(5E)-1-methyl-3-(2-methylpropyl)-5-(1H-pyrrol-2-ylmethylidene)-2-sulfanylidene-imidazolidin-4-one

Systemtic Name: (5E)-1-methyl-3-(2-methylpropyl)-5-(1H-pyrrol-2-ylmethylidene)-2-sulfanylidene-imidazolidin-4-one Openeye Name: (5E)-3-isobutyl-1-methyl-5-(1H-pyrrol-2-ylmethylene)-2-thioxo-imidazolidin-4-one CAS Name: (5E)-1-methyl-3-(2-methylpropyl)-5-(1H-pyrrol-2-ylmethylidene)-2-sulfanylidene-4-imidazolidinone IUPAC Name: (5E)-1-methyl-3-(2-methylpropyl)-5-(1H-pyrrol-2-ylmethylidene)-2-sulfanylideneimidazolidin-4-one Traditional Name: (5E)-3-isobutyl-1-methyl-5-(1H-pyrrol-2-ylmethylene)-2-thioxo-4-imidazolidinone Formula: C13H17N3OS MolecularWeight: 263.35858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C(=CC2=CC=CN2)N(C1=S)C

Isomeric SMILES

CC(C)CN1C(=O)/C(=C\C2=CC=CN2)/N(C1=S)C

InChI

InChI=1S/C13H17N3OS/c1-9(2)8-16-12(17)11(15(3)13(16)18)7-10-5-4-6-14-10/h4-7,9,14H,8H2,1-3H3/b11-7+