N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-3-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]benzamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-3-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]benzamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-3-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]benzamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-3-[[(4-methyl-1,3-benzoxazol-2-yl)thio]methyl]benzamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-3-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]benzamide Traditional Name: N-homoveratryl-N-methyl-3-[[(4-methyl-1,3-benzoxazol-2-yl)thio]methyl]benzamide Formula: C27H28N2O4S MolecularWeight: 476.58722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)OC(=N2)SCC3=CC=CC(=C3)C(=O)N(C)CCC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC1=C2C(=CC=C1)OC(=N2)SCC3=CC=CC(=C3)C(=O)N(C)CCC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C27H28N2O4S/c1-18-7-5-10-23-25(18)28-27(33-23)34-17-20-8-6-9-21(15-20)26(30)29(2)14-13-19-11-12-22(31-3)24(16-19)32-4/h5-12,15-16H,13-14,17H2,1-4H3