N-butyl-2-[3-ethoxypropyl(2-phenylsulfanylethanoyl)amino]-N-[(1-methylpyrrol-2-yl)methyl]ethanamide

Systemtic Name: N-butyl-2-[3-ethoxypropyl(2-phenylsulfanylethanoyl)amino]-N-[(1-methylpyrrol-2-yl)methyl]ethanamide Openeye Name: N-butyl-2-[3-ethoxypropyl-(2-phenylsulfanylacetyl)amino]-N-[(1-methylpyrrol-2-yl)methyl]acetamide CAS Name: N-butyl-2-[3-ethoxypropyl-[1-oxo-2-(phenylthio)ethyl]amino]-N-[(1-methyl-2-pyrrolyl)methyl]acetamide IUPAC Name: N-butyl-2-[3-ethoxypropyl-(2-phenylsulfanylacetyl)amino]-N-[(1-methylpyrrol-2-yl)methyl]acetamide Traditional Name: N-butyl-2-[3-ethoxypropyl-[2-(phenylthio)acetyl]amino]-N-[(1-methylpyrrol-2-yl)methyl]acetamide Formula: C25H37N3O3S MolecularWeight: 459.64458

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CN1C)C(=O)CN(CCCOCC)C(=O)CSC2=CC=CC=C2

Isomeric SMILES

CCCCN(CC1=CC=CN1C)C(=O)CN(CCCOCC)C(=O)CSC2=CC=CC=C2

InChI

InChI=1S/C25H37N3O3S/c1-4-6-16-27(19-22-12-10-15-26(22)3)24(29)20-28(17-11-18-31-5-2)25(30)21-32-23-13-8-7-9-14-23/h7-10,12-15H,4-6,11,16-21H2,1-3H3