ethyl 3-[2-(8-methyl-4-oxidanylidene-chromeno[4,3-c]pyrazol-1-yl)ethanoylamino]-3-thiophen-2-yl-propanoate

Systemtic Name: ethyl 3-[2-(8-methyl-4-oxidanylidene-chromeno[4,3-c]pyrazol-1-yl)ethanoylamino]-3-thiophen-2-yl-propanoate Openeye Name: ethyl 3-[[2-(8-methyl-4-oxo-chromeno[4,3-c]pyrazol-1-yl)acetyl]amino]-3-(2-thienyl)propanoate CAS Name: 3-[[2-(8-methyl-4-oxo-1-[1]benzopyrano[4,3-c]pyrazolyl)-1-oxoethyl]amino]-3-thiophen-2-ylpropanoic acid ethyl ester IUPAC Name: ethyl 3-[[2-(8-methyl-4-oxochromeno[4,3-c]pyrazol-1-yl)acetyl]amino]-3-thiophen-2-ylpropanoate Traditional Name: 3-[[2-(4-keto-8-methyl-chromeno[4,3-c]pyrazol-1-yl)acetyl]amino]-3-(2-thienyl)propionic acid ethyl ester Formula: C22H21N3O5S MolecularWeight: 439.48424

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1=CC=CS1)NC(=O)CN2C3=C(C=N2)C(=O)OC4=C3C=C(C=C4)C

Isomeric SMILES

CCOC(=O)CC(C1=CC=CS1)NC(=O)CN2C3=C(C=N2)C(=O)OC4=C3C=C(C=C4)C

InChI

InChI=1S/C22H21N3O5S/c1-3-29-20(27)10-16(18-5-4-8-31-18)24-19(26)12-25-21-14-9-13(2)6-7-17(14)30-22(28)15(21)11-23-25/h4-9,11,16H,3,10,12H2,1-2H3,(H,24,26)