ethyl 4-[[3-carbamothioyl-5-(hydroxymethyl)-8-methyl-pyrano[2,3-c]pyridin-2-ylidene]amino]benzoate

Systemtic Name: ethyl 4-[[3-carbamothioyl-5-(hydroxymethyl)-8-methyl-pyrano[2,3-c]pyridin-2-ylidene]amino]benzoate Openeye Name: ethyl 4-[[3-carbamothioyl-5-(hydroxymethyl)-8-methyl-pyrano[2,3-c]pyridin-2-ylidene]amino]benzoate CAS Name: 4-[[3-carbamothioyl-5-(hydroxymethyl)-8-methyl-2-pyrano[2,3-c]pyridinylidene]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[3-carbamothioyl-5-(hydroxymethyl)-8-methylpyrano[2,3-c]pyridin-2-ylidene]amino]benzoate Traditional Name: 4-[(8-methyl-5-methylol-3-thiocarbamoyl-pyrano[2,3-c]pyridin-2-ylidene)amino]benzoic acid ethyl ester Formula: C20H19N3O4S MolecularWeight: 397.44756

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N=C2C(=CC3=C(O2)C(=NC=C3CO)C)C(=S)N

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N=C2C(=CC3=C(O2)C(=NC=C3CO)C)C(=S)N

InChI

InChI=1S/C20H19N3O4S/c1-3-26-20(25)12-4-6-14(7-5-12)23-19-16(18(21)28)8-15-13(10-24)9-22-11(2)17(15)27-19/h4-9,24H,3,10H2,1-2H3,(H2,21,28)