N-(3-azanyl-3-azanylidene-propyl)-4-(2-bromanylprop-2-enoylamino)-1-methyl-pyrrole-2-carboxamide

Systemtic Name: N-(3-azanyl-3-azanylidene-propyl)-4-(2-bromanylprop-2-enoylamino)-1-methyl-pyrrole-2-carboxamide Openeye Name: N-(3-amino-3-imino-propyl)-4-(2-bromoprop-2-enoylamino)-1-methyl-pyrrole-2-carboxamide CAS Name: N-(3-amino-3-iminopropyl)-4-[(2-bromo-1-oxoprop-2-enyl)amino]-1-methyl-2-pyrrolecarboxamide IUPAC Name: N-(3-amino-3-iminopropyl)-4-(2-bromoprop-2-enoylamino)-1-methylpyrrole-2-carboxamide Traditional Name: N-(3-amino-3-imino-propyl)-4-[(2-bromoacryloyl)amino]-1-methyl-pyrrole-2-carboxamide Formula: C12H16BrN5O2 MolecularWeight: 342.19174

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NCCC(=N)N)NC(=O)C(=C)Br

Isomeric SMILES

CN1C=C(C=C1C(=O)NCCC(=N)N)NC(=O)C(=C)Br

InChI

InChI=1S/C12H16BrN5O2/c1-7(13)11(19)17-8-5-9(18(2)6-8)12(20)16-4-3-10(14)15/h5-6H,1,3-4H2,2H3,(H3,14,15)(H,16,20)(H,17,19)