2-morpholin-4-ylethyl N-[2-[(5-bromanyl-2-methoxy-phenyl)methylsulfanyl]phenyl]carbamate

Systemtic Name: 2-morpholin-4-ylethyl N-[2-[(5-bromanyl-2-methoxy-phenyl)methylsulfanyl]phenyl]carbamate Openeye Name: 2-morpholinoethyl N-[2-[(5-bromo-2-methoxy-phenyl)methylsulfanyl]phenyl]carbamate CAS Name: N-[2-[(5-bromo-2-methoxyphenyl)methylthio]phenyl]carbamic acid 2-(4-morpholinyl)ethyl ester IUPAC Name: 2-morpholin-4-ylethyl N-[2-[(5-bromo-2-methoxyphenyl)methylsulfanyl]phenyl]carbamate Traditional Name: N-[2-[(5-bromo-2-methoxy-benzyl)thio]phenyl]carbamic acid 2-morpholinoethyl ester Formula: C21H25BrN2O4S MolecularWeight: 481.4032

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)CSC2=CC=CC=C2NC(=O)OCCN3CCOCC3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)CSC2=CC=CC=C2NC(=O)OCCN3CCOCC3

InChI

InChI=1S/C21H25BrN2O4S/c1-26-19-7-6-17(22)14-16(19)15-29-20-5-3-2-4-18(20)23-21(25)28-13-10-24-8-11-27-12-9-24/h2-7,14H,8-13,15H2,1H3,(H,23,25)