N-[(1R)-1-cyclopropylethyl]-2-[3-[(4-fluorophenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[(1R)-1-cyclopropylethyl]-2-[3-[(4-fluorophenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-[(1R)-1-cyclopropylethyl]-2-[3-[(4-fluorophenyl)methyl]-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-[(1R)-1-cyclopropylethyl]-2-[[3-[(4-fluorophenyl)methyl]-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-[(1R)-1-cyclopropylethyl]-2-[3-[(4-fluorophenyl)methyl]-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-[(1R)-1-cyclopropylethyl]-2-[[3-(4-fluorobenzyl)-4-keto-quinazolin-2-yl]thio]acetamide Formula: C22H22FN3O2S MolecularWeight: 411.492383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CC1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC4=CC=C(C=C4)F

Isomeric SMILES

C[C@H](C1CC1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC4=CC=C(C=C4)F

InChI

InChI=1S/C22H22FN3O2S/c1-14(16-8-9-16)24-20(27)13-29-22-25-19-5-3-2-4-18(19)21(28)26(22)12-15-6-10-17(23)11-7-15/h2-7,10-11,14,16H,8-9,12-13H2,1H3,(H,24,27)/t14-/m1/s1