N-(4-chloranyl-2,5-dimethoxy-phenyl)-4-(1,3-dithiolan-2-yl)benzamide

Systemtic Name: N-(4-chloranyl-2,5-dimethoxy-phenyl)-4-(1,3-dithiolan-2-yl)benzamide Openeye Name: N-(4-chloro-2,5-dimethoxy-phenyl)-4-(1,3-dithiolan-2-yl)benzamide CAS Name: N-(4-chloro-2,5-dimethoxyphenyl)-4-(1,3-dithiolan-2-yl)benzamide IUPAC Name: N-(4-chloro-2,5-dimethoxyphenyl)-4-(1,3-dithiolan-2-yl)benzamide Traditional Name: N-(4-chloro-2,5-dimethoxy-phenyl)-4-(1,3-dithiolan-2-yl)benzamide Formula: C18H18ClNO3S2 MolecularWeight: 395.92342

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)C2=CC=C(C=C2)C3SCCS3)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)C2=CC=C(C=C2)C3SCCS3)OC)Cl

InChI

InChI=1S/C18H18ClNO3S2/c1-22-15-10-14(16(23-2)9-13(15)19)20-17(21)11-3-5-12(6-4-11)18-24-7-8-25-18/h3-6,9-10,18H,7-8H2,1-2H3,(H,20,21)