(5R)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-methyl-2-sulfanylidene-imidazolidin-4-one

Systemtic Name: (5R)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-methyl-2-sulfanylidene-imidazolidin-4-one Openeye Name: (5R)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-methyl-2-thioxo-imidazolidin-4-one CAS Name: (5R)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-methyl-2-sulfanylidene-4-imidazolidinone IUPAC Name: (5R)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-methyl-2-sulfanylideneimidazolidin-4-one Traditional Name: (5R)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-methyl-2-thioxo-4-imidazolidinone Formula: C13H14N2O3S MolecularWeight: 278.32686

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C(=S)N1)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

C[C@@H]1C(=O)N(C(=S)N1)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C13H14N2O3S/c1-8-12(16)15(13(19)14-8)9-3-4-10-11(7-9)18-6-2-5-17-10/h3-4,7-8H,2,5-6H2,1H3,(H,14,19)/t8-/m1/s1