(2R)-2-[6-bromanyl-3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-cyclohexyl-propanamide

Systemtic Name: (2R)-2-[6-bromanyl-3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-cyclohexyl-propanamide Openeye Name: (2R)-2-[6-bromo-3-(2-methoxyethyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-cyclohexyl-propanamide CAS Name: (2R)-2-[[6-bromo-3-(2-methoxyethyl)-4-oxo-2-quinazolinyl]thio]-N-cyclohexylpropanamide IUPAC Name: (2R)-2-[6-bromo-3-(2-methoxyethyl)-4-oxoquinazolin-2-yl]sulfanyl-N-cyclohexylpropanamide Traditional Name: (2R)-2-[[6-bromo-4-keto-3-(2-methoxyethyl)quinazolin-2-yl]thio]-N-cyclohexyl-propionamide Formula: C20H26BrN3O3S MolecularWeight: 468.40774

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCC1)SC2=NC3=C(C=C(C=C3)Br)C(=O)N2CCOC

Isomeric SMILES

C[C@H](C(=O)NC1CCCCC1)SC2=NC3=C(C=C(C=C3)Br)C(=O)N2CCOC

InChI

InChI=1S/C20H26BrN3O3S/c1-13(18(25)22-15-6-4-3-5-7-15)28-20-23-17-9-8-14(21)12-16(17)19(26)24(20)10-11-27-2/h8-9,12-13,15H,3-7,10-11H2,1-2H3,(H,22,25)/t13-/m1/s1