2-[4-[3-[(2-aminophenyl)carbamothioylamino]propyl]-5-oxidanylidene-2-sulfanylidene-imidazolidin-1-yl]ethanoic acid

Systemtic Name: 2-[4-[3-[(2-aminophenyl)carbamothioylamino]propyl]-5-oxidanylidene-2-sulfanylidene-imidazolidin-1-yl]ethanoic acid Openeye Name: 2-[4-[3-[(2-aminophenyl)carbamothioylamino]propyl]-5-oxo-2-thioxo-imidazolidin-1-yl]acetic acid CAS Name: 2-[4-[3-[[(2-aminoanilino)-sulfanylidenemethyl]amino]propyl]-5-oxo-2-sulfanylidene-1-imidazolidinyl]acetic acid IUPAC Name: 2-[4-[3-[(2-aminophenyl)carbamothioylamino]propyl]-5-oxo-2-sulfanylideneimidazolidin-1-yl]acetic acid Traditional Name: 2-[4-[3-[(2-aminophenyl)thiocarbamoylamino]propyl]-5-keto-2-thioxo-imidazolidin-1-yl]acetic acid Formula: C15H19N5O3S2 MolecularWeight: 381.47306

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N)NC(=S)NCCCC2C(=O)N(C(=S)N2)CC(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)N)NC(=S)NCCCC2C(=O)N(C(=S)N2)CC(=O)O

InChI

InChI=1S/C15H19N5O3S2/c16-9-4-1-2-5-10(9)18-14(24)17-7-3-6-11-13(23)20(8-12(21)22)15(25)19-11/h1-2,4-5,11H,3,6-8,16H2,(H,19,25)(H,21,22)(H2,17,18,24)