(2R)-N-(5-chloranylpyridin-2-yl)-2-[3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: (2R)-N-(5-chloranylpyridin-2-yl)-2-[3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide Openeye Name: (2R)-N-(5-chloro-2-pyridyl)-2-(3-isobutyl-4-oxo-quinazolin-2-yl)sulfanyl-propanamide CAS Name: (2R)-N-(5-chloro-2-pyridinyl)-2-[[3-(2-methylpropyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: (2R)-N-(5-chloropyridin-2-yl)-2-[3-(2-methylpropyl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: (2R)-N-(5-chloro-2-pyridyl)-2-[(3-isobutyl-4-keto-quinazolin-2-yl)thio]propionamide Formula: C20H21ClN4O2S MolecularWeight: 416.92434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3=NC=C(C=C3)Cl

Isomeric SMILES

C[C@H](C(=O)NC1=NC=C(C=C1)Cl)SC2=NC3=CC=CC=C3C(=O)N2CC(C)C

InChI

InChI=1S/C20H21ClN4O2S/c1-12(2)11-25-19(27)15-6-4-5-7-16(15)23-20(25)28-13(3)18(26)24-17-9-8-14(21)10-22-17/h4-10,12-13H,11H2,1-3H3,(H,22,24,26)/t13-/m1/s1