2-piperidin-1-ylethyl N-[2-[(5-bromanyl-2-methoxy-phenyl)methylsulfanyl]phenyl]carbamate

Systemtic Name: 2-piperidin-1-ylethyl N-[2-[(5-bromanyl-2-methoxy-phenyl)methylsulfanyl]phenyl]carbamate Openeye Name: 2-(1-piperidyl)ethyl N-[2-[(5-bromo-2-methoxy-phenyl)methylsulfanyl]phenyl]carbamate CAS Name: N-[2-[(5-bromo-2-methoxyphenyl)methylthio]phenyl]carbamic acid 2-(1-piperidinyl)ethyl ester IUPAC Name: 2-piperidin-1-ylethyl N-[2-[(5-bromo-2-methoxyphenyl)methylsulfanyl]phenyl]carbamate Traditional Name: N-[2-[(5-bromo-2-methoxy-benzyl)thio]phenyl]carbamic acid 2-piperidinoethyl ester Formula: C22H27BrN2O3S MolecularWeight: 479.43038

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)CSC2=CC=CC=C2NC(=O)OCCN3CCCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)CSC2=CC=CC=C2NC(=O)OCCN3CCCCC3

InChI

InChI=1S/C22H27BrN2O3S/c1-27-20-10-9-18(23)15-17(20)16-29-21-8-4-3-7-19(21)24-22(26)28-14-13-25-11-5-2-6-12-25/h3-4,7-10,15H,2,5-6,11-14,16H2,1H3,(H,24,26)