4-[[4-[(4-acetamido-1-methyl-pyrrol-2-yl)carbonylamino]-1-methyl-pyrrol-2-yl]carbonylamino]-1-(3-azanylpropyl)pyrrole-2-carboxamide

Systemtic Name: 4-[[4-[(4-acetamido-1-methyl-pyrrol-2-yl)carbonylamino]-1-methyl-pyrrol-2-yl]carbonylamino]-1-(3-azanylpropyl)pyrrole-2-carboxamide Openeye Name: 4-[[4-[(4-acetamido-1-methyl-pyrrole-2-carbonyl)amino]-1-methyl-pyrrole-2-carbonyl]amino]-1-(3-aminopropyl)pyrrole-2-carboxamide CAS Name: 4-[[[4-[[(4-acetamido-1-methyl-2-pyrrolyl)-oxomethyl]amino]-1-methyl-2-pyrrolyl]-oxomethyl]amino]-1-(3-aminopropyl)-2-pyrrolecarboxamide IUPAC Name: 4-[[4-[(4-acetamido-1-methylpyrrole-2-carbonyl)amino]-1-methylpyrrole-2-carbonyl]amino]-1-(3-aminopropyl)pyrrole-2-carboxamide Traditional Name: 4-[[4-[(4-acetamido-1-methyl-pyrrole-2-carbonyl)amino]-1-methyl-pyrrole-2-carbonyl]amino]-1-(3-aminopropyl)pyrrole-2-carboxamide Formula: C22H28N8O4 MolecularWeight: 468.50892

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CN(C(=C1)C(=O)NC2=CN(C(=C2)C(=O)NC3=CN(C(=C3)C(=O)N)CCCN)C)C

Isomeric SMILES

CC(=O)NC1=CN(C(=C1)C(=O)NC2=CN(C(=C2)C(=O)NC3=CN(C(=C3)C(=O)N)CCCN)C)C

InChI

InChI=1S/C22H28N8O4/c1-13(31)25-14-8-18(28(2)10-14)21(33)26-15-9-19(29(3)11-15)22(34)27-16-7-17(20(24)32)30(12-16)6-4-5-23/h7-12H,4-6,23H2,1-3H3,(H2,24,32)(H,25,31)(H,26,33)(H,27,34)