2-[6-bromanyl-3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(2R)-5-methylhexan-2-yl]ethanamide

Systemtic Name: 2-[6-bromanyl-3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(2R)-5-methylhexan-2-yl]ethanamide Openeye Name: 2-[6-bromo-3-(2-methoxyethyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-[(1R)-1,4-dimethylpentyl]acetamide CAS Name: 2-[[6-bromo-3-(2-methoxyethyl)-4-oxo-2-quinazolinyl]thio]-N-[(2R)-5-methylhexan-2-yl]acetamide IUPAC Name: 2-[6-bromo-3-(2-methoxyethyl)-4-oxoquinazolin-2-yl]sulfanyl-N-[(2R)-5-methylhexan-2-yl]acetamide Traditional Name: 2-[[6-bromo-4-keto-3-(2-methoxyethyl)quinazolin-2-yl]thio]-N-[(1R)-1,4-dimethylpentyl]acetamide Formula: C20H28BrN3O3S MolecularWeight: 470.42362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)NC(=O)CSC1=NC2=C(C=C(C=C2)Br)C(=O)N1CCOC

Isomeric SMILES

C[C@H](CCC(C)C)NC(=O)CSC1=NC2=C(C=C(C=C2)Br)C(=O)N1CCOC

InChI

InChI=1S/C20H28BrN3O3S/c1-13(2)5-6-14(3)22-18(25)12-28-20-23-17-8-7-15(21)11-16(17)19(26)24(20)9-10-27-4/h7-8,11,13-14H,5-6,9-10,12H2,1-4H3,(H,22,25)/t14-/m1/s1