2-(4-methoxyphenyl)sulfanyl-N-[(4-pyrrolidin-1-ylphenyl)methyl]propanamide

Systemtic Name: 2-(4-methoxyphenyl)sulfanyl-N-[(4-pyrrolidin-1-ylphenyl)methyl]propanamide Openeye Name: 2-(4-methoxyphenyl)sulfanyl-N-[(4-pyrrolidin-1-ylphenyl)methyl]propanamide CAS Name: 2-[(4-methoxyphenyl)thio]-N-[[4-(1-pyrrolidinyl)phenyl]methyl]propanamide IUPAC Name: 2-(4-methoxyphenyl)sulfanyl-N-[(4-pyrrolidin-1-ylphenyl)methyl]propanamide Traditional Name: 2-[(4-methoxyphenyl)thio]-N-(4-pyrrolidinobenzyl)propionamide Formula: C21H26N2O2S MolecularWeight: 370.50834

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=C(C=C1)N2CCCC2)SC3=CC=C(C=C3)OC

Isomeric SMILES

CC(C(=O)NCC1=CC=C(C=C1)N2CCCC2)SC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H26N2O2S/c1-16(26-20-11-9-19(25-2)10-12-20)21(24)22-15-17-5-7-18(8-6-17)23-13-3-4-14-23/h5-12,16H,3-4,13-15H2,1-2H3,(H,22,24)