4-bromanyl-1-methyl-N'-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)carbonyl-pyrrole-2-carbohydrazide

Systemtic Name: 4-bromanyl-1-methyl-N'-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)carbonyl-pyrrole-2-carbohydrazide Openeye Name: 4-bromo-1-methyl-N'-[2-methyl-5-(1-piperidylsulfonyl)benzoyl]pyrrole-2-carbohydrazide CAS Name: 4-bromo-1-methyl-N'-[[2-methyl-5-(1-piperidinylsulfonyl)phenyl]-oxomethyl]-2-pyrrolecarbohydrazide IUPAC Name: 4-bromo-1-methyl-N'-(2-methyl-5-piperidin-1-ylsulfonylbenzoyl)pyrrole-2-carbohydrazide Traditional Name: 4-bromo-1-methyl-N'-(2-methyl-5-piperidinosulfonyl-benzoyl)pyrrole-2-carbohydrazide Formula: C19H23BrN4O4S MolecularWeight: 483.37932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)NNC(=O)C3=CC(=CN3C)Br

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)NNC(=O)C3=CC(=CN3C)Br

InChI

InChI=1S/C19H23BrN4O4S/c1-13-6-7-15(29(27,28)24-8-4-3-5-9-24)11-16(13)18(25)21-22-19(26)17-10-14(20)12-23(17)2/h6-7,10-12H,3-5,8-9H2,1-2H3,(H,21,25)(H,22,26)