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

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-4-(1,3-dithiolan-2-yl)benzamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-4-(1,3-dithiolan-2-yl)benzamide CAS Name: N-(4-bromo-3-methylphenyl)-4-(1,3-dithiolan-2-yl)benzamide IUPAC Name: N-(4-bromo-3-methylphenyl)-4-(1,3-dithiolan-2-yl)benzamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-4-(1,3-dithiolan-2-yl)benzamide Formula: C17H16BrNOS2 MolecularWeight: 394.34904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2=CC=C(C=C2)C3SCCS3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2=CC=C(C=C2)C3SCCS3)Br

InChI

InChI=1S/C17H16BrNOS2/c1-11-10-14(6-7-15(11)18)19-16(20)12-2-4-13(5-3-12)17-21-8-9-22-17/h2-7,10,17H,8-9H2,1H3,(H,19,20)