2-[3-(4-cyanophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]ethanamide

Systemtic Name: 2-[3-(4-cyanophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]ethanamide Openeye Name: N-[(4S)-chroman-4-yl]-2-[3-(4-cyanophenyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: 2-[[3-(4-cyanophenyl)-4-oxo-2-quinazolinyl]thio]-N-[(4S)-3,4-dihydro-2H-1-benzopyran-4-yl]acetamide IUPAC Name: 2-[3-(4-cyanophenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]acetamide Traditional Name: N-[(4S)-chroman-4-yl]-2-[[3-(4-cyanophenyl)-4-keto-quinazolin-2-yl]thio]acetamide Formula: C26H20N4O3S MolecularWeight: 468.527

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC=C2C1NC(=O)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)C#N

Isomeric SMILES

C1COC2=CC=CC=C2[C@H]1NC(=O)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)C#N

InChI

InChI=1S/C26H20N4O3S/c27-15-17-9-11-18(12-10-17)30-25(32)20-6-1-3-7-21(20)29-26(30)34-16-24(31)28-22-13-14-33-23-8-4-2-5-19(22)23/h1-12,22H,13-14,16H2,(H,28,31)/t22-/m0/s1