2-[2-methoxy-5-[(Z)-C-methyl-N-[(4-propan-2-ylphenyl)carbamothioylamino]carbonimidoyl]phenyl]ethanoate

Systemtic Name: 2-[2-methoxy-5-[(Z)-C-methyl-N-[(4-propan-2-ylphenyl)carbamothioylamino]carbonimidoyl]phenyl]ethanoate Openeye Name: 2-[5-[(Z)-N-[(4-isopropylphenyl)carbamothioylamino]-C-methyl-carbonimidoyl]-2-methoxy-phenyl]acetate CAS Name: 2-[2-methoxy-5-[(1Z)-1-[[(4-propan-2-ylanilino)-sulfanylidenemethyl]hydrazinylidene]ethyl]phenyl]acetate IUPAC Name: 2-[2-methoxy-5-[(Z)-C-methyl-N-[(4-propan-2-ylphenyl)carbamothioylamino]carbonimidoyl]phenyl]acetate Traditional Name: 2-[2-methoxy-5-[(Z)-C-methyl-N-(p-cumenylthiocarbamoylamino)carbonimidoyl]phenyl]acetate Formula: C21H24N3O3S- MolecularWeight: 398.49856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=S)NN=C(C)C2=CC(=C(C=C2)OC)CC(=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=S)N/N=C(/C)\C2=CC(=C(C=C2)OC)CC(=O)[O-]

InChI

InChI=1S/C21H25N3O3S/c1-13(2)15-5-8-18(9-6-15)22-21(28)24-23-14(3)16-7-10-19(27-4)17(11-16)12-20(25)26/h5-11,13H,12H2,1-4H3,(H,25,26)(H2,22,24,28)/p-1/b23-14-