3-(4-butylsulfanylphenyl)-N-(2-pyrrol-1-ylethyl)propanamide

Systemtic Name: 3-(4-butylsulfanylphenyl)-N-(2-pyrrol-1-ylethyl)propanamide Openeye Name: 3-(4-butylsulfanylphenyl)-N-(2-pyrrol-1-ylethyl)propanamide CAS Name: 3-[4-(butylthio)phenyl]-N-[2-(1-pyrrolyl)ethyl]propanamide IUPAC Name: 3-(4-butylsulfanylphenyl)-N-(2-pyrrol-1-ylethyl)propanamide Traditional Name: 3-[4-(butylthio)phenyl]-N-(2-pyrrol-1-ylethyl)propionamide Formula: C19H26N2OS MolecularWeight: 330.48754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=CC=C(C=C1)CCC(=O)NCCN2C=CC=C2

Isomeric SMILES

CCCCSC1=CC=C(C=C1)CCC(=O)NCCN2C=CC=C2

InChI

InChI=1S/C19H26N2OS/c1-2-3-16-23-18-9-6-17(7-10-18)8-11-19(22)20-12-15-21-13-4-5-14-21/h4-7,9-10,13-14H,2-3,8,11-12,15-16H2,1H3,(H,20,22)