4-bromanyl-1-methyl-N'-(5-morpholin-4-yl-4-phenyl-thiophen-2-yl)carbonyl-pyrrole-2-carbohydrazide

Systemtic Name: 4-bromanyl-1-methyl-N'-(5-morpholin-4-yl-4-phenyl-thiophen-2-yl)carbonyl-pyrrole-2-carbohydrazide Openeye Name: 4-bromo-1-methyl-N'-(5-morpholino-4-phenyl-thiophene-2-carbonyl)pyrrole-2-carbohydrazide CAS Name: 4-bromo-1-methyl-N'-[[5-(4-morpholinyl)-4-phenyl-2-thiophenyl]-oxomethyl]-2-pyrrolecarbohydrazide IUPAC Name: 4-bromo-1-methyl-N'-(5-morpholin-4-yl-4-phenylthiophene-2-carbonyl)pyrrole-2-carbohydrazide Traditional Name: 4-bromo-1-methyl-N'-(5-morpholino-4-phenyl-thiophene-2-carbonyl)pyrrole-2-carbohydrazide Formula: C21H21BrN4O3S MolecularWeight: 489.38544

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NNC(=O)C2=CC(=C(S2)N3CCOCC3)C4=CC=CC=C4)Br

Isomeric SMILES

CN1C=C(C=C1C(=O)NNC(=O)C2=CC(=C(S2)N3CCOCC3)C4=CC=CC=C4)Br

InChI

InChI=1S/C21H21BrN4O3S/c1-25-13-15(22)11-17(25)19(27)23-24-20(28)18-12-16(14-5-3-2-4-6-14)21(30-18)26-7-9-29-10-8-26/h2-6,11-13H,7-10H2,1H3,(H,23,27)(H,24,28)