2-[5-[(Z)-N-[(3,4-dimethoxyphenyl)carbamothioylamino]-C-methyl-carbonimidoyl]-2-methoxy-phenyl]ethanoate

Systemtic Name: 2-[5-[(Z)-N-[(3,4-dimethoxyphenyl)carbamothioylamino]-C-methyl-carbonimidoyl]-2-methoxy-phenyl]ethanoate Openeye Name: 2-[5-[(Z)-N-[(3,4-dimethoxyphenyl)carbamothioylamino]-C-methyl-carbonimidoyl]-2-methoxy-phenyl]acetate CAS Name: 2-[5-[(1Z)-1-[[(3,4-dimethoxyanilino)-sulfanylidenemethyl]hydrazinylidene]ethyl]-2-methoxyphenyl]acetate IUPAC Name: 2-[5-[(Z)-N-[(3,4-dimethoxyphenyl)carbamothioylamino]-C-methylcarbonimidoyl]-2-methoxyphenyl]acetate Traditional Name: 2-[5-[(Z)-N-[(3,4-dimethoxyphenyl)thiocarbamoylamino]-C-methyl-carbonimidoyl]-2-methoxy-phenyl]acetate Formula: C20H22N3O5S- MolecularWeight: 416.47078

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NC1=CC(=C(C=C1)OC)OC)C2=CC(=C(C=C2)OC)CC(=O)[O-]

Isomeric SMILES

C/C(=N/NC(=S)NC1=CC(=C(C=C1)OC)OC)/C2=CC(=C(C=C2)OC)CC(=O)[O-]

InChI

InChI=1S/C20H23N3O5S/c1-12(13-5-7-16(26-2)14(9-13)10-19(24)25)22-23-20(29)21-15-6-8-17(27-3)18(11-15)28-4/h5-9,11H,10H2,1-4H3,(H,24,25)(H2,21,23,29)/p-1/b22-12-