N-[[2-(dimethylaminomethyl)phenyl]methyl]-2-(4-nitrophenyl)sulfanyl-propanamide

Systemtic Name: N-[[2-(dimethylaminomethyl)phenyl]methyl]-2-(4-nitrophenyl)sulfanyl-propanamide Openeye Name: N-[[2-(dimethylaminomethyl)phenyl]methyl]-2-(4-nitrophenyl)sulfanyl-propanamide CAS Name: N-[[2-(dimethylaminomethyl)phenyl]methyl]-2-[(4-nitrophenyl)thio]propanamide IUPAC Name: N-[[2-(dimethylaminomethyl)phenyl]methyl]-2-(4-nitrophenyl)sulfanylpropanamide Traditional Name: N-[2-(dimethylaminomethyl)benzyl]-2-[(4-nitrophenyl)thio]propionamide Formula: C19H23N3O3S MolecularWeight: 373.46922

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1CN(C)C)SC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NCC1=CC=CC=C1CN(C)C)SC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H23N3O3S/c1-14(26-18-10-8-17(9-11-18)22(24)25)19(23)20-12-15-6-4-5-7-16(15)13-21(2)3/h4-11,14H,12-13H2,1-3H3,(H,20,23)