(5R)-5-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-(2-morpholin-4-ium-4-ylethyl)-2-sulfanylidene-imidazolidin-4-one

Systemtic Name: (5R)-5-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-(2-morpholin-4-ium-4-ylethyl)-2-sulfanylidene-imidazolidin-4-one Openeye Name: (5R)-5-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-(2-morpholin-4-ium-4-ylethyl)-2-thioxo-imidazolidin-4-one CAS Name: (5R)-5-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-3-[2-(4-morpholin-4-iumyl)ethyl]-2-sulfanylidene-4-imidazolidinone IUPAC Name: (5R)-5-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3-(2-morpholin-4-ium-4-ylethyl)-2-sulfanylideneimidazolidin-4-one Traditional Name: (5R)-5-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-(2-morpholin-4-ium-4-ylethyl)-2-thioxo-4-imidazolidinone Formula: C20H26N5O2S+ MolecularWeight: 400.51774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C3C(=O)N(C(=S)N3)CC[NH+]4CCOCC4

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)[C@@H]3C(=O)N(C(=S)N3)CC[NH+]4CCOCC4

InChI

InChI=1S/C20H25N5O2S/c1-14-17(15(2)25(22-14)16-6-4-3-5-7-16)18-19(26)24(20(28)21-18)9-8-23-10-12-27-13-11-23/h3-7,18H,8-13H2,1-2H3,(H,21,28)/p+1/t18-/m1/s1