N-[[1-(3-bromanyl-4-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-2-(2-methyl-1,3-dithiolan-2-yl)ethanamide

Systemtic Name: N-[[1-(3-bromanyl-4-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-2-(2-methyl-1,3-dithiolan-2-yl)ethanamide Openeye Name: N-[[1-(3-bromo-4-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-2-(2-methyl-1,3-dithiolan-2-yl)acetamide CAS Name: N-[[1-(3-bromo-4-methylphenyl)-2,5-dimethyl-3-pyrrolyl]methylideneamino]-2-(2-methyl-1,3-dithiolan-2-yl)acetamide IUPAC Name: N-[[1-(3-bromo-4-methylphenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]-2-(2-methyl-1,3-dithiolan-2-yl)acetamide Traditional Name: N-[[1-(3-bromo-4-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-2-(2-methyl-1,3-dithiolan-2-yl)acetamide Formula: C20H24BrN3OS2 MolecularWeight: 466.45806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=CC(=C2C)C=NNC(=O)CC3(SCCS3)C)C)Br

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=CC(=C2C)C=NNC(=O)CC3(SCCS3)C)C)Br

InChI

InChI=1S/C20H24BrN3OS2/c1-13-5-6-17(10-18(13)21)24-14(2)9-16(15(24)3)12-22-23-19(25)11-20(4)26-7-8-27-20/h5-6,9-10,12H,7-8,11H2,1-4H3,(H,23,25)