2-[7-chloranyl-3-(3-methoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-cyclopentylpyrazol-3-yl)ethanamide

Systemtic Name: 2-[7-chloranyl-3-(3-methoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-cyclopentylpyrazol-3-yl)ethanamide Openeye Name: 2-[7-chloro-3-(3-methoxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(2-cyclopentylpyrazol-3-yl)acetamide CAS Name: 2-[[7-chloro-3-(3-methoxypropyl)-4-oxo-2-quinazolinyl]thio]-N-(2-cyclopentyl-3-pyrazolyl)acetamide IUPAC Name: 2-[7-chloro-3-(3-methoxypropyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(2-cyclopentylpyrazol-3-yl)acetamide Traditional Name: 2-[[7-chloro-4-keto-3-(3-methoxypropyl)quinazolin-2-yl]thio]-N-(2-cyclopentylpyrazol-3-yl)acetamide Formula: C22H26ClN5O3S MolecularWeight: 475.99154

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)NC3=CC=NN3C4CCCC4

Isomeric SMILES

COCCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)NC3=CC=NN3C4CCCC4

InChI

InChI=1S/C22H26ClN5O3S/c1-31-12-4-11-27-21(30)17-8-7-15(23)13-18(17)25-22(27)32-14-20(29)26-19-9-10-24-28(19)16-5-2-3-6-16/h7-10,13,16H,2-6,11-12,14H2,1H3,(H,26,29)