2-[2-(dimethylamino)-2-oxidanylidene-ethyl]sulfanyl-N-ethyl-N-[(4-phenylmethoxyphenyl)methyl]benzamide

Systemtic Name: 2-[2-(dimethylamino)-2-oxidanylidene-ethyl]sulfanyl-N-ethyl-N-[(4-phenylmethoxyphenyl)methyl]benzamide Openeye Name: N-[(4-benzyloxyphenyl)methyl]-2-[2-(dimethylamino)-2-oxo-ethyl]sulfanyl-N-ethyl-benzamide CAS Name: 2-[[2-(dimethylamino)-2-oxoethyl]thio]-N-ethyl-N-[(4-phenylmethoxyphenyl)methyl]benzamide IUPAC Name: 2-[2-(dimethylamino)-2-oxoethyl]sulfanyl-N-ethyl-N-[(4-phenylmethoxyphenyl)methyl]benzamide Traditional Name: N-(4-benzoxybenzyl)-2-[[2-(dimethylamino)-2-keto-ethyl]thio]-N-ethyl-benzamide Formula: C27H30N2O3S MolecularWeight: 462.6037

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)C3=CC=CC=C3SCC(=O)N(C)C

Isomeric SMILES

CCN(CC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)C3=CC=CC=C3SCC(=O)N(C)C

InChI

InChI=1S/C27H30N2O3S/c1-4-29(27(31)24-12-8-9-13-25(24)33-20-26(30)28(2)3)18-21-14-16-23(17-15-21)32-19-22-10-6-5-7-11-22/h5-17H,4,18-20H2,1-3H3