N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-2-[3-(2,5-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-2-[3-(2,5-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-[(4S)-chroman-4-yl]-2-[3-(2,5-dimethylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-[(4S)-3,4-dihydro-2H-1-benzopyran-4-yl]-2-[[3-(2,5-dimethylphenyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-2-[3-(2,5-dimethylphenyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-[(4S)-chroman-4-yl]-2-[[3-(2,5-dimethylphenyl)-4-keto-quinazolin-2-yl]thio]acetamide Formula: C27H25N3O3S MolecularWeight: 471.5707

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4CCOC5=CC=CC=C45

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)N[C@H]4CCOC5=CC=CC=C45

InChI

InChI=1S/C27H25N3O3S/c1-17-11-12-18(2)23(15-17)30-26(32)20-8-3-5-9-21(20)29-27(30)34-16-25(31)28-22-13-14-33-24-10-6-4-7-19(22)24/h3-12,15,22H,13-14,16H2,1-2H3,(H,28,31)/t22-/m0/s1