(2R)-N-(3-cyanothiophen-2-yl)-2-(4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: (2R)-N-(3-cyanothiophen-2-yl)-2-(4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: (2R)-N-(3-cyano-2-thienyl)-2-(3-isopropyl-4-oxo-quinazolin-2-yl)sulfanyl-propanamide CAS Name: (2R)-N-(3-cyano-2-thiophenyl)-2-[(4-oxo-3-propan-2-yl-2-quinazolinyl)thio]propanamide IUPAC Name: (2R)-N-(3-cyanothiophen-2-yl)-2-(4-oxo-3-propan-2-ylquinazolin-2-yl)sulfanylpropanamide Traditional Name: (2R)-N-(3-cyano-2-thienyl)-2-[(3-isopropyl-4-keto-quinazolin-2-yl)thio]propionamide Formula: C19H18N4O2S2 MolecularWeight: 398.50182

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=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)N2C(C)C

InChI

InChI=1S/C19H18N4O2S2/c1-11(2)23-18(25)14-6-4-5-7-15(14)21-19(23)27-12(3)16(24)22-17-13(10-20)8-9-26-17/h4-9,11-12H,1-3H3,(H,22,24)/t12-/m1/s1