ethyl 2-[4-[2-[(3-chloranyl-2-methyl-phenyl)carbamothioyl]hydrazinyl]-2-methyl-2-pyridin-3-yl-chromen-6-yl]oxyethanoate

Systemtic Name: ethyl 2-[4-[2-[(3-chloranyl-2-methyl-phenyl)carbamothioyl]hydrazinyl]-2-methyl-2-pyridin-3-yl-chromen-6-yl]oxyethanoate Openeye Name: ethyl 2-[4-[2-[(3-chloro-2-methyl-phenyl)carbamothioyl]hydrazino]-2-methyl-2-(3-pyridyl)chromen-6-yl]oxyacetate CAS Name: 2-[[4-[[(3-chloro-2-methylanilino)-sulfanylidenemethyl]hydrazo]-2-methyl-2-(3-pyridinyl)-1-benzopyran-6-yl]oxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[2-[(3-chloro-2-methylphenyl)carbamothioyl]hydrazinyl]-2-methyl-2-pyridin-3-ylchromen-6-yl]oxyacetate Traditional Name: 2-[4-[N'-[(3-chloro-2-methyl-phenyl)thiocarbamoyl]hydrazino]-2-methyl-2-(3-pyridyl)chromen-6-yl]oxyacetic acid ethyl ester Formula: C27H27ClN4O4S MolecularWeight: 539.04568

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=CC2=C(C=C1)OC(C=C2NNC(=S)NC3=C(C(=CC=C3)Cl)C)(C)C4=CN=CC=C4

Isomeric SMILES

CCOC(=O)COC1=CC2=C(C=C1)OC(C=C2NNC(=S)NC3=C(C(=CC=C3)Cl)C)(C)C4=CN=CC=C4

InChI

InChI=1S/C27H27ClN4O4S/c1-4-34-25(33)16-35-19-10-11-24-20(13-19)23(14-27(3,36-24)18-7-6-12-29-15-18)31-32-26(37)30-22-9-5-8-21(28)17(22)2/h5-15,31H,4,16H2,1-3H3,(H2,30,32,37)