N-(2-dimethylaminoethyl)-2-[3-(3-fluorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(phenylmethyl)ethanamide

Systemtic Name: N-(2-dimethylaminoethyl)-2-[3-(3-fluorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-N-(2-dimethylaminoethyl)-2-[3-(3-fluorophenyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-(2-dimethylaminoethyl)-2-[[3-(3-fluorophenyl)-4-oxo-2-quinazolinyl]thio]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-N-(2-dimethylaminoethyl)-2-[3-(3-fluorophenyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-benzyl-N-(2-dimethylaminoethyl)-2-[[3-(3-fluorophenyl)-4-keto-quinazolin-2-yl]thio]acetamide Formula: C27H27FN4O2S MolecularWeight: 490.592283

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN(CC1=CC=CC=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC(=CC=C4)F

Isomeric SMILES

CN(C)CCN(CC1=CC=CC=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC(=CC=C4)F

InChI

InChI=1S/C27H27FN4O2S/c1-30(2)15-16-31(18-20-9-4-3-5-10-20)25(33)19-35-27-29-24-14-7-6-13-23(24)26(34)32(27)22-12-8-11-21(28)17-22/h3-14,17H,15-16,18-19H2,1-2H3