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4-oxidanylidene-3-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]quinazoline-6-carboxylic acid

4-oxidanylidene-3-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]quinazoline-6-carboxylic acid

Systemtic Name:4-oxidanylidene-3-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]quinazoline-6-carboxylic acid
Openeye Name:4-oxo-3-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]quinazoline-6-carboxylic acid
CAS Name:4-oxo-3-[[4-(1-pyrrolidinylsulfonyl)phenyl]methyl]-6-quinazolinecarboxylic acid
IUPAC Name:4-oxo-3-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]quinazoline-6-carboxylic acid
Traditional Name:4-keto-3-(4-pyrrolidinosulfonylbenzyl)quinazoline-6-carboxylic acid
Formula: C20H19N3O5S
MolecularWeight: 413.44696
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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)CN3C=NC4=C(C3=O)C=C(C=C4)C(=O)O


Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)CN3C=NC4=C(C3=O)C=C(C=C4)C(=O)O


InChI

InChI=1S/C20H19N3O5S/c24-19-17-11-15(20(25)26)5-8-18(17)21-13-22(19)12-14-3-6-16(7-4-14)29(27,28)23-9-1-2-10-23/h3-8,11,13H,1-2,9-10,12H2,(H,25,26)


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