ethyl (4S)-2-azanyl-6-methyl-5-(phenylcarbamoyl)-4-(1H-pyrrol-2-yl)-4H-pyran-3-carboxylate

Systemtic Name: ethyl (4S)-2-azanyl-6-methyl-5-(phenylcarbamoyl)-4-(1H-pyrrol-2-yl)-4H-pyran-3-carboxylate Openeye Name: ethyl (4S)-2-amino-6-methyl-5-(phenylcarbamoyl)-4-(1H-pyrrol-2-yl)-4H-pyran-3-carboxylate CAS Name: (4S)-2-amino-5-[anilino(oxo)methyl]-6-methyl-4-(1H-pyrrol-2-yl)-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-2-amino-6-methyl-5-(phenylcarbamoyl)-4-(1H-pyrrol-2-yl)-4H-pyran-3-carboxylate Traditional Name: (4S)-2-amino-6-methyl-5-(phenylcarbamoyl)-4-(1H-pyrrol-2-yl)-4H-pyran-3-carboxylic acid ethyl ester Formula: C20H21N3O4 MolecularWeight: 367.39844

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C(C1C2=CC=CN2)C(=O)NC3=CC=CC=C3)C)N

Isomeric SMILES

CCOC(=O)C1=C(OC(=C([C@@H]1C2=CC=CN2)C(=O)NC3=CC=CC=C3)C)N

InChI

InChI=1S/C20H21N3O4/c1-3-26-20(25)17-16(14-10-7-11-22-14)15(12(2)27-18(17)21)19(24)23-13-8-5-4-6-9-13/h4-11,16,22H,3,21H2,1-2H3,(H,23,24)/t16-/m0/s1