methyl 4-[(1-methyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)carbonylamino]benzoate

Systemtic Name: methyl 4-[(1-methyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)carbonylamino]benzoate Openeye Name: methyl 4-[(1-methyl-4H-thiochromeno[4,3-c]pyrazole-3-carbonyl)amino]benzoate CAS Name: 4-[[(1-methyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(1-methyl-4H-thiochromeno[4,3-c]pyrazole-3-carbonyl)amino]benzoate Traditional Name: 4-[(1-methyl-4H-thiochromeno[4,3-c]pyrazole-3-carbonyl)amino]benzoic acid methyl ester Formula: C20H17N3O3S MolecularWeight: 379.43228

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CSC3=CC=CC=C32)C(=N1)C(=O)NC4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CN1C2=C(CSC3=CC=CC=C32)C(=N1)C(=O)NC4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C20H17N3O3S/c1-23-18-14-5-3-4-6-16(14)27-11-15(18)17(22-23)19(24)21-13-9-7-12(8-10-13)20(25)26-2/h3-10H,11H2,1-2H3,(H,21,24)