2-[2-methoxy-5-[(Z)-C-methyl-N-(propan-2-ylcarbamothioylamino)carbonimidoyl]phenyl]ethanoic acid

Systemtic Name: 2-[2-methoxy-5-[(Z)-C-methyl-N-(propan-2-ylcarbamothioylamino)carbonimidoyl]phenyl]ethanoic acid Openeye Name: 2-[5-[(Z)-N-(isopropylcarbamothioylamino)-C-methyl-carbonimidoyl]-2-methoxy-phenyl]acetic acid CAS Name: 2-[2-methoxy-5-[(1Z)-1-[[(propan-2-ylamino)-sulfanylidenemethyl]hydrazinylidene]ethyl]phenyl]acetic acid IUPAC Name: 2-[2-methoxy-5-[(Z)-C-methyl-N-(propan-2-ylcarbamothioylamino)carbonimidoyl]phenyl]acetic acid Traditional Name: 2-[5-[(Z)-N-(isopropylthiocarbamoylamino)-C-methyl-carbonimidoyl]-2-methoxy-phenyl]acetic acid Formula: C15H21N3O3S MolecularWeight: 323.41054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=S)NN=C(C)C1=CC(=C(C=C1)OC)CC(=O)O

Isomeric SMILES

CC(C)NC(=S)N/N=C(/C)\C1=CC(=C(C=C1)OC)CC(=O)O

InChI

InChI=1S/C15H21N3O3S/c1-9(2)16-15(22)18-17-10(3)11-5-6-13(21-4)12(7-11)8-14(19)20/h5-7,9H,8H2,1-4H3,(H,19,20)(H2,16,18,22)/b17-10-