4-(1,3-dithiolan-2-yl)-N-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]benzamide

Systemtic Name: 4-(1,3-dithiolan-2-yl)-N-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]benzamide Openeye Name: N-[(4-benzyloxy-3-methoxy-phenyl)methyl]-4-(1,3-dithiolan-2-yl)benzamide CAS Name: 4-(1,3-dithiolan-2-yl)-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]benzamide IUPAC Name: 4-(1,3-dithiolan-2-yl)-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]benzamide Traditional Name: N-(4-benzoxy-3-methoxy-benzyl)-4-(1,3-dithiolan-2-yl)benzamide Formula: C25H25NO3S2 MolecularWeight: 451.6009

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNC(=O)C2=CC=C(C=C2)C3SCCS3)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)CNC(=O)C2=CC=C(C=C2)C3SCCS3)OCC4=CC=CC=C4

InChI

InChI=1S/C25H25NO3S2/c1-28-23-15-19(7-12-22(23)29-17-18-5-3-2-4-6-18)16-26-24(27)20-8-10-21(11-9-20)25-30-13-14-31-25/h2-12,15,25H,13-14,16-17H2,1H3,(H,26,27)