2-[2-methoxy-5-[(Z)-N-[(3-methoxyphenyl)carbamothioylamino]-C-methyl-carbonimidoyl]phenyl]ethanoic acid

Systemtic Name: 2-[2-methoxy-5-[(Z)-N-[(3-methoxyphenyl)carbamothioylamino]-C-methyl-carbonimidoyl]phenyl]ethanoic acid Openeye Name: 2-[2-methoxy-5-[(Z)-N-[(3-methoxyphenyl)carbamothioylamino]-C-methyl-carbonimidoyl]phenyl]acetic acid CAS Name: 2-[2-methoxy-5-[(1Z)-1-[[(3-methoxyanilino)-sulfanylidenemethyl]hydrazinylidene]ethyl]phenyl]acetic acid IUPAC Name: 2-[2-methoxy-5-[(Z)-N-[(3-methoxyphenyl)carbamothioylamino]-C-methylcarbonimidoyl]phenyl]acetic acid Traditional Name: 2-[2-methoxy-5-[(Z)-N-[(3-methoxyphenyl)thiocarbamoylamino]-C-methyl-carbonimidoyl]phenyl]acetic acid Formula: C19H21N3O4S MolecularWeight: 387.45274

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N3O4S/c1-12(13-7-8-17(26-3)14(9-13)10-18(23)24)21-22-19(27)20-15-5-4-6-16(11-15)25-2/h4-9,11H,10H2,1-3H3,(H,23,24)(H2,20,22,27)/b21-12-