3-[[(4R)-4-(3-methoxyphenyl)-4-methyl-2,5-bis(oxidanylidene)imidazolidin-1-yl]carbamothioylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[[(4R)-4-(3-methoxyphenyl)-4-methyl-2,5-bis(oxidanylidene)imidazolidin-1-yl]carbamothioylamino]propyl-dimethyl-azanium Openeye Name: 3-[[(4R)-4-(3-methoxyphenyl)-4-methyl-2,5-dioxo-imidazolidin-1-yl]carbamothioylamino]propyl-dimethyl-ammonium CAS Name: 3-[[[[(4R)-4-(3-methoxyphenyl)-4-methyl-2,5-dioxo-1-imidazolidinyl]amino]-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[(4R)-4-(3-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]carbamothioylamino]propyl-dimethylazanium Traditional Name: 3-[[(4R)-2,5-diketo-4-(3-methoxyphenyl)-4-methyl-imidazolidin-1-yl]thiocarbamoylamino]propyl-dimethyl-ammonium Formula: C17H26N5O3S+ MolecularWeight: 380.48504

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(C(=O)N1)NC(=S)NCCC[NH+](C)C)C2=CC(=CC=C2)OC

Isomeric SMILES

C[C@]1(C(=O)N(C(=O)N1)NC(=S)NCCC[NH+](C)C)C2=CC(=CC=C2)OC

InChI

InChI=1S/C17H25N5O3S/c1-17(12-7-5-8-13(11-12)25-4)14(23)22(16(24)19-17)20-15(26)18-9-6-10-21(2)3/h5,7-8,11H,6,9-10H2,1-4H3,(H,19,24)(H2,18,20,26)/p+1/t17-/m1/s1