methyl 6-[[(2S)-2-[(4-methylphenyl)sulfonylamino]-3-phenyl-propanoyl]amino]-2-oxidanylidene-chromene-3-carboxylate

Systemtic Name: methyl 6-[[(2S)-2-[(4-methylphenyl)sulfonylamino]-3-phenyl-propanoyl]amino]-2-oxidanylidene-chromene-3-carboxylate Openeye Name: methyl 2-oxo-6-[[(2S)-3-phenyl-2-(p-tolylsulfonylamino)propanoyl]amino]chromene-3-carboxylate CAS Name: 6-[[(2S)-2-[(4-methylphenyl)sulfonylamino]-1-oxo-3-phenylpropyl]amino]-2-oxo-1-benzopyran-3-carboxylic acid methyl ester IUPAC Name: methyl 6-[[(2S)-2-[(4-methylphenyl)sulfonylamino]-3-phenylpropanoyl]amino]-2-oxochromene-3-carboxylate Traditional Name: 2-keto-6-[[(2S)-3-phenyl-2-(tosylamino)propanoyl]amino]chromene-3-carboxylic acid methyl ester Formula: C27H24N2O7S MolecularWeight: 520.55366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC=CC=C2)C(=O)NC3=CC4=C(C=C3)OC(=O)C(=C4)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](CC2=CC=CC=C2)C(=O)NC3=CC4=C(C=C3)OC(=O)C(=C4)C(=O)OC

InChI

InChI=1S/C27H24N2O7S/c1-17-8-11-21(12-9-17)37(33,34)29-23(14-18-6-4-3-5-7-18)25(30)28-20-10-13-24-19(15-20)16-22(26(31)35-2)27(32)36-24/h3-13,15-16,23,29H,14H2,1-2H3,(H,28,30)/t23-/m0/s1