ethyl 2-[[4-(5-aminocarbonyl-1-methyl-pyrrol-3-yl)sulfonylpiperazin-1-yl]methyl]-4-methyl-quinoline-3-carboxylate

Systemtic Name: ethyl 2-[[4-(5-aminocarbonyl-1-methyl-pyrrol-3-yl)sulfonylpiperazin-1-yl]methyl]-4-methyl-quinoline-3-carboxylate Openeye Name: ethyl 2-[[4-(5-carbamoyl-1-methyl-pyrrol-3-yl)sulfonylpiperazin-1-yl]methyl]-4-methyl-quinoline-3-carboxylate CAS Name: 2-[[4-[(5-carbamoyl-1-methyl-3-pyrrolyl)sulfonyl]-1-piperazinyl]methyl]-4-methyl-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[4-(5-carbamoyl-1-methylpyrrol-3-yl)sulfonylpiperazin-1-yl]methyl]-4-methylquinoline-3-carboxylate Traditional Name: 2-[[4-(5-carbamoyl-1-methyl-pyrrol-3-yl)sulfonylpiperazino]methyl]-4-methyl-quinoline-3-carboxylic acid ethyl ester Formula: C24H29N5O5S MolecularWeight: 499.58256

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N=C1CN3CCN(CC3)S(=O)(=O)C4=CN(C(=C4)C(=O)N)C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N=C1CN3CCN(CC3)S(=O)(=O)C4=CN(C(=C4)C(=O)N)C)C

InChI

InChI=1S/C24H29N5O5S/c1-4-34-24(31)22-16(2)18-7-5-6-8-19(18)26-20(22)15-28-9-11-29(12-10-28)35(32,33)17-13-21(23(25)30)27(3)14-17/h5-8,13-14H,4,9-12,15H2,1-3H3,(H2,25,30)