N-(4-bromanyl-3-methyl-phenyl)-7-(5-methylthiophen-2-yl)-4,7-bis(oxidanylidene)heptanamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-7-(5-methylthiophen-2-yl)-4,7-bis(oxidanylidene)heptanamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-7-(5-methyl-2-thienyl)-4,7-dioxo-heptanamide CAS Name: N-(4-bromo-3-methylphenyl)-7-(5-methyl-2-thiophenyl)-4,7-dioxoheptanamide IUPAC Name: N-(4-bromo-3-methylphenyl)-7-(5-methylthiophen-2-yl)-4,7-dioxoheptanamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-4,7-diketo-7-(5-methyl-2-thienyl)enanthamide Formula: C19H20BrNO3S MolecularWeight: 422.336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)CCC(=O)CCC(=O)NC2=CC(=C(C=C2)Br)C

Isomeric SMILES

CC1=CC=C(S1)C(=O)CCC(=O)CCC(=O)NC2=CC(=C(C=C2)Br)C

InChI

InChI=1S/C19H20BrNO3S/c1-12-11-14(4-7-16(12)20)21-19(24)10-6-15(22)5-8-17(23)18-9-3-13(2)25-18/h3-4,7,9,11H,5-6,8,10H2,1-2H3,(H,21,24)