methyl 4-(4-methylphenyl)-2-(9H-xanthen-9-ylcarbonylamino)thiophene-3-carboxylate

Systemtic Name: methyl 4-(4-methylphenyl)-2-(9H-xanthen-9-ylcarbonylamino)thiophene-3-carboxylate Openeye Name: methyl 4-(p-tolyl)-2-(9H-xanthene-9-carbonylamino)thiophene-3-carboxylate CAS Name: 4-(4-methylphenyl)-2-[[oxo(9H-xanthen-9-yl)methyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-methylphenyl)-2-(9H-xanthene-9-carbonylamino)thiophene-3-carboxylate Traditional Name: 4-(p-tolyl)-2-(9H-xanthene-9-carbonylamino)thiophene-3-carboxylic acid methyl ester Formula: C27H21NO4S MolecularWeight: 455.52494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)C3C4=CC=CC=C4OC5=CC=CC=C35

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)C3C4=CC=CC=C4OC5=CC=CC=C35

InChI

InChI=1S/C27H21NO4S/c1-16-11-13-17(14-12-16)20-15-33-26(24(20)27(30)31-2)28-25(29)23-18-7-3-5-9-21(18)32-22-10-6-4-8-19(22)23/h3-15,23H,1-2H3,(H,28,29)