5-[5-azanylidene-4,4-dimethyl-3-(5-oxidanylpentyl)-2-sulfanylidene-imidazolidin-1-yl]-3H-2-benzofuran-1-one

Systemtic Name: 5-[5-azanylidene-4,4-dimethyl-3-(5-oxidanylpentyl)-2-sulfanylidene-imidazolidin-1-yl]-3H-2-benzofuran-1-one Openeye Name: 5-[3-(5-hydroxypentyl)-5-imino-4,4-dimethyl-2-thioxo-imidazolidin-1-yl]-3H-isobenzofuran-1-one CAS Name: 5-[3-(5-hydroxypentyl)-5-imino-4,4-dimethyl-2-sulfanylidene-1-imidazolidinyl]-3H-isobenzofuran-1-one IUPAC Name: 5-[3-(5-hydroxypentyl)-5-imino-4,4-dimethyl-2-sulfanylideneimidazolidin-1-yl]-3H-2-benzofuran-1-one Traditional Name: 5-[3-(5-hydroxypentyl)-5-imino-4,4-dimethyl-2-thioxo-imidazolidin-1-yl]phthalide Formula: C18H23N3O3S MolecularWeight: 361.45852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=N)N(C(=S)N1CCCCCO)C2=CC3=C(C=C2)C(=O)OC3)C

Isomeric SMILES

CC1(C(=N)N(C(=S)N1CCCCCO)C2=CC3=C(C=C2)C(=O)OC3)C

InChI

InChI=1S/C18H23N3O3S/c1-18(2)16(19)21(17(25)20(18)8-4-3-5-9-22)13-6-7-14-12(10-13)11-24-15(14)23/h6-7,10,19,22H,3-5,8-9,11H2,1-2H3