2-[(3-bromophenyl)methylsulfanyl]-N-[(E)-[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methylideneamino]ethanamide

Systemtic Name: 2-[(3-bromophenyl)methylsulfanyl]-N-[(E)-[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methylideneamino]ethanamide Openeye Name: 2-[(3-bromophenyl)methylsulfanyl]-N-[(E)-[2,5-dimethyl-1-(p-tolyl)pyrrol-3-yl]methyleneamino]acetamide CAS Name: 2-[(3-bromophenyl)methylthio]-N-[(E)-[2,5-dimethyl-1-(4-methylphenyl)-3-pyrrolyl]methylideneamino]acetamide IUPAC Name: 2-[(3-bromophenyl)methylsulfanyl]-N-[(E)-[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methylideneamino]acetamide Traditional Name: 2-[(3-bromobenzyl)thio]-N-[(E)-[2,5-dimethyl-1-(p-tolyl)pyrrol-3-yl]methyleneamino]acetamide Formula: C23H24BrN3OS MolecularWeight: 470.42516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=C2C)C=NNC(=O)CSCC3=CC(=CC=C3)Br)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=C2C)/C=N/NC(=O)CSCC3=CC(=CC=C3)Br)C

InChI

InChI=1S/C23H24BrN3OS/c1-16-7-9-22(10-8-16)27-17(2)11-20(18(27)3)13-25-26-23(28)15-29-14-19-5-4-6-21(24)12-19/h4-13H,14-15H2,1-3H3,(H,26,28)/b25-13+