(2R)-N-(3-cyanophenyl)-2-[3-[(4-methoxyphenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: (2R)-N-(3-cyanophenyl)-2-[3-[(4-methoxyphenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide Openeye Name: (2R)-N-(3-cyanophenyl)-2-[3-[(4-methoxyphenyl)methyl]-4-oxo-quinazolin-2-yl]sulfanyl-propanamide CAS Name: (2R)-N-(3-cyanophenyl)-2-[[3-[(4-methoxyphenyl)methyl]-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: (2R)-N-(3-cyanophenyl)-2-[3-[(4-methoxyphenyl)methyl]-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: (2R)-N-(3-cyanophenyl)-2-[(4-keto-3-p-anisyl-quinazolin-2-yl)thio]propionamide Formula: C26H22N4O3S MolecularWeight: 470.54288

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)C#N)SC2=NC3=CC=CC=C3C(=O)N2CC4=CC=C(C=C4)OC

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC(=C1)C#N)SC2=NC3=CC=CC=C3C(=O)N2CC4=CC=C(C=C4)OC

InChI

InChI=1S/C26H22N4O3S/c1-17(24(31)28-20-7-5-6-19(14-20)15-27)34-26-29-23-9-4-3-8-22(23)25(32)30(26)16-18-10-12-21(33-2)13-11-18/h3-14,17H,16H2,1-2H3,(H,28,31)/t17-/m1/s1