ethyl 4-azanyl-6-[(4-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]quinoline-3-carboxylate

Systemtic Name: ethyl 4-azanyl-6-[(4-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]quinoline-3-carboxylate Openeye Name: ethyl 4-amino-6-[(4-pyrrolidin-1-ylsulfonylbenzoyl)amino]quinoline-3-carboxylate CAS Name: 4-amino-6-[[oxo-[4-(1-pyrrolidinylsulfonyl)phenyl]methyl]amino]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-6-[(4-pyrrolidin-1-ylsulfonylbenzoyl)amino]quinoline-3-carboxylate Traditional Name: 4-amino-6-[(4-pyrrolidinosulfonylbenzoyl)amino]quinoline-3-carboxylic acid ethyl ester Formula: C23H24N4O5S MolecularWeight: 468.52546

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C=CC(=CC2=C1N)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CCOC(=O)C1=CN=C2C=CC(=CC2=C1N)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C23H24N4O5S/c1-2-32-23(29)19-14-25-20-10-7-16(13-18(20)21(19)24)26-22(28)15-5-8-17(9-6-15)33(30,31)27-11-3-4-12-27/h5-10,13-14H,2-4,11-12H2,1H3,(H2,24,25)(H,26,28)