propan-2-yl 4-cyano-3-methyl-5-(9H-xanthen-9-ylcarbonylamino)thiophene-2-carboxylate

Systemtic Name: propan-2-yl 4-cyano-3-methyl-5-(9H-xanthen-9-ylcarbonylamino)thiophene-2-carboxylate Openeye Name: isopropyl 4-cyano-3-methyl-5-(9H-xanthene-9-carbonylamino)thiophene-2-carboxylate CAS Name: 4-cyano-3-methyl-5-[[oxo(9H-xanthen-9-yl)methyl]amino]-2-thiophenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-cyano-3-methyl-5-(9H-xanthene-9-carbonylamino)thiophene-2-carboxylate Traditional Name: 4-cyano-3-methyl-5-(9H-xanthene-9-carbonylamino)thiophene-2-carboxylic acid isopropyl ester Formula: C24H20N2O4S MolecularWeight: 432.4916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24)C(=O)OC(C)C

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24)C(=O)OC(C)C

InChI

InChI=1S/C24H20N2O4S/c1-13(2)29-24(28)21-14(3)17(12-25)23(31-21)26-22(27)20-15-8-4-6-10-18(15)30-19-11-7-5-9-16(19)20/h4-11,13,20H,1-3H3,(H,26,27)