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(4-azanylquinazolin-2-yl)methyl 2-piperidin-1-ylsulfonylbenzoate

(4-azanylquinazolin-2-yl)methyl 2-piperidin-1-ylsulfonylbenzoate

Systemtic Name:(4-azanylquinazolin-2-yl)methyl 2-piperidin-1-ylsulfonylbenzoate
Openeye Name:(4-aminoquinazolin-2-yl)methyl 2-(1-piperidylsulfonyl)benzoate
CAS Name:2-(1-piperidinylsulfonyl)benzoic acid (4-amino-2-quinazolinyl)methyl ester
IUPAC Name:(4-aminoquinazolin-2-yl)methyl 2-piperidin-1-ylsulfonylbenzoate
Traditional Name:2-piperidinosulfonylbenzoic acid (4-aminoquinazolin-2-yl)methyl ester
Formula: C21H22N4O4S
MolecularWeight: 426.48878
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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C(=O)OCC3=NC4=CC=CC=C4C(=N3)N


Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C(=O)OCC3=NC4=CC=CC=C4C(=N3)N


InChI

InChI=1S/C21H22N4O4S/c22-20-15-8-2-4-10-17(15)23-19(24-20)14-29-21(26)16-9-3-5-11-18(16)30(27,28)25-12-6-1-7-13-25/h2-5,8-11H,1,6-7,12-14H2,(H2,22,23,24)


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