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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)CSC2=NC3=C(C=C(C=C3)Br)C(=O)N2CCOC

Isomeric SMILES

CC1CCCCC1NC(=O)CSC2=NC3=C(C=C(C=C3)Br)C(=O)N2CCOC

InChI

InChI=1S/C20H26BrN3O3S/c1-13-5-3-4-6-16(13)22-18(25)12-28-20-23-17-8-7-14(21)11-15(17)19(26)24(20)9-10-27-2/h7-8,11,13,16H,3-6,9-10,12H2,1-2H3,(H,22,25)