N-[2-[(4-methoxyphenyl)methylsulfanyl]phenyl]-2-(2-methylpropoxy)-N-(2-pyrrolidin-1-ylethyl)ethanamide

Systemtic Name: N-[2-[(4-methoxyphenyl)methylsulfanyl]phenyl]-2-(2-methylpropoxy)-N-(2-pyrrolidin-1-ylethyl)ethanamide Openeye Name: 2-isobutoxy-N-[2-[(4-methoxyphenyl)methylsulfanyl]phenyl]-N-(2-pyrrolidin-1-ylethyl)acetamide CAS Name: N-[2-[(4-methoxyphenyl)methylthio]phenyl]-2-(2-methylpropoxy)-N-[2-(1-pyrrolidinyl)ethyl]acetamide IUPAC Name: N-[2-[(4-methoxyphenyl)methylsulfanyl]phenyl]-2-(2-methylpropoxy)-N-(2-pyrrolidin-1-ylethyl)acetamide Traditional Name: 2-isobutoxy-N-[2-[(4-methoxybenzyl)thio]phenyl]-N-(2-pyrrolidinoethyl)acetamide Formula: C26H36N2O3S MolecularWeight: 458.633182

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COCC(=O)N(CCN1CCCC1)C2=CC=CC=C2SCC3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)COCC(=O)N(CCN1CCCC1)C2=CC=CC=C2S[14CH2]C3=CC=C(C=C3)OC

InChI

InChI=1S/C26H36N2O3S/c1-21(2)18-31-19-26(29)28(17-16-27-14-6-7-15-27)24-8-4-5-9-25(24)32-20-22-10-12-23(30-3)13-11-22/h4-5,8-13,21H,6-7,14-20H2,1-3H3/i20+2