N-(3-azanyl-3-azanylidene-propyl)-4-[[4-[[4-[[4-(2-fluoranylprop-2-enoylamino)-1-methyl-pyrrol-2-yl]carbonylamino]-1-methyl-pyrrol-2-yl]carbonylamino]-1-methyl-pyrrol-2-yl]carbonylamino]-1-methyl-pyrrole-2-carboxamide

Systemtic Name: N-(3-azanyl-3-azanylidene-propyl)-4-[[4-[[4-[[4-(2-fluoranylprop-2-enoylamino)-1-methyl-pyrrol-2-yl]carbonylamino]-1-methyl-pyrrol-2-yl]carbonylamino]-1-methyl-pyrrol-2-yl]carbonylamino]-1-methyl-pyrrole-2-carboxamide Openeye Name: N-(3-amino-3-imino-propyl)-4-[[4-[[4-[[4-(2-fluoroprop-2-enoylamino)-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-pyrrole-2-carboxamide CAS Name: N-(3-amino-3-iminopropyl)-4-[[[4-[[[4-[[[4-[(2-fluoro-1-oxoprop-2-enyl)amino]-1-methyl-2-pyrrolyl]-oxomethyl]amino]-1-methyl-2-pyrrolyl]-oxomethyl]amino]-1-methyl-2-pyrrolyl]-oxomethyl]amino]-1-methyl-2-pyrrolecarboxamide IUPAC Name: N-(3-amino-3-iminopropyl)-4-[[4-[[4-[[4-(2-fluoroprop-2-enoylamino)-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrole-2-carboxamide Traditional Name: N-(3-amino-3-imino-propyl)-4-[[4-[[4-[[4-[(2-fluoroacryloyl)amino]-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-pyrrole-2-carboxamide Formula: C30H34FN11O5 MolecularWeight: 647.660063

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NCCC(=N)N)NC(=O)C2=CC(=CN2C)NC(=O)C3=CC(=CN3C)NC(=O)C4=CC(=CN4C)NC(=O)C(=C)F

Isomeric SMILES

CN1C=C(C=C1C(=O)NCCC(=N)N)NC(=O)C2=CC(=CN2C)NC(=O)C3=CC(=CN3C)NC(=O)C4=CC(=CN4C)NC(=O)C(=C)F

InChI

InChI=1S/C30H34FN11O5/c1-16(31)26(43)35-17-9-22(40(3)12-17)28(45)37-19-11-24(42(5)14-19)30(47)38-20-10-23(41(4)15-20)29(46)36-18-8-21(39(2)13-18)27(44)34-7-6-25(32)33/h8-15H,1,6-7H2,2-5H3,(H3,32,33)(H,34,44)(H,35,43)(H,36,46)(H,37,45)(H,38,47)