N-[(3,4-dimethoxyphenyl)methyl]-2-(1-methylimidazol-2-yl)sulfanyl-propanamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(1-methylimidazol-2-yl)sulfanyl-propanamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(1-methylimidazol-2-yl)sulfanyl-propanamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[(1-methyl-2-imidazolyl)thio]propanamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(1-methylimidazol-2-yl)sulfanylpropanamide Traditional Name: 2-[(1-methylimidazol-2-yl)thio]-N-veratryl-propionamide Formula: C16H21N3O3S MolecularWeight: 335.42124

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC(=C(C=C1)OC)OC)SC2=NC=CN2C

Isomeric SMILES

CC(C(=O)NCC1=CC(=C(C=C1)OC)OC)SC2=NC=CN2C

InChI

InChI=1S/C16H21N3O3S/c1-11(23-16-17-7-8-19(16)2)15(20)18-10-12-5-6-13(21-3)14(9-12)22-4/h5-9,11H,10H2,1-4H3,(H,18,20)