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

Systemtic Name: (2R)-N-(3-cyanothiophen-2-yl)-2-[3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide Openeye Name: (2R)-N-(3-cyano-2-thienyl)-2-(3-isobutyl-4-oxo-quinazolin-2-yl)sulfanyl-propanamide CAS Name: (2R)-N-(3-cyano-2-thiophenyl)-2-[[3-(2-methylpropyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: (2R)-N-(3-cyanothiophen-2-yl)-2-[3-(2-methylpropyl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: (2R)-N-(3-cyano-2-thienyl)-2-[(3-isobutyl-4-keto-quinazolin-2-yl)thio]propionamide Formula: C20H20N4O2S2 MolecularWeight: 412.5284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3=C(C=CS3)C#N

Isomeric SMILES

C[C@H](C(=O)NC1=C(C=CS1)C#N)SC2=NC3=CC=CC=C3C(=O)N2CC(C)C

InChI

InChI=1S/C20H20N4O2S2/c1-12(2)11-24-19(26)15-6-4-5-7-16(15)22-20(24)28-13(3)17(25)23-18-14(10-21)8-9-27-18/h4-9,12-13H,11H2,1-3H3,(H,23,25)/t13-/m1/s1