N-(4-bromanyl-3-methyl-phenyl)-4-(1,3-dithian-2-yl)benzamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-4-(1,3-dithian-2-yl)benzamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-4-(1,3-dithian-2-yl)benzamide CAS Name: N-(4-bromo-3-methylphenyl)-4-(1,3-dithian-2-yl)benzamide IUPAC Name: N-(4-bromo-3-methylphenyl)-4-(1,3-dithian-2-yl)benzamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-4-(1,3-dithian-2-yl)benzamide Formula: C18H18BrNOS2 MolecularWeight: 408.37562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2=CC=C(C=C2)C3SCCCS3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2=CC=C(C=C2)C3SCCCS3)Br

InChI

InChI=1S/C18H18BrNOS2/c1-12-11-15(7-8-16(12)19)20-17(21)13-3-5-14(6-4-13)18-22-9-2-10-23-18/h3-8,11,18H,2,9-10H2,1H3,(H,20,21)