N-(3-azanyl-3-azanylidene-propyl)-4-[(N,N'-dicyclohexylcarbamimidoyl)amino]-1-methyl-pyrrole-2-carboxamide

Systemtic Name: N-(3-azanyl-3-azanylidene-propyl)-4-[(N,N'-dicyclohexylcarbamimidoyl)amino]-1-methyl-pyrrole-2-carboxamide Openeye Name: N-(3-amino-3-imino-propyl)-4-[(N,N'-dicyclohexylcarbamimidoyl)amino]-1-methyl-pyrrole-2-carboxamide CAS Name: N-(3-amino-3-iminopropyl)-4-[[(cyclohexylamino)-cyclohexyliminomethyl]amino]-1-methyl-2-pyrrolecarboxamide IUPAC Name: N-(3-amino-3-iminopropyl)-4-[(N,N'-dicyclohexylcarbamimidoyl)amino]-1-methylpyrrole-2-carboxamide Traditional Name: N-(3-amino-3-imino-propyl)-4-[(N,N'-dicyclohexylamidino)amino]-1-methyl-pyrrole-2-carboxamide Formula: C22H37N7O MolecularWeight: 415.57548

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NCCC(=N)N)NC(=NC2CCCCC2)NC3CCCCC3

Isomeric SMILES

CN1C=C(C=C1C(=O)NCCC(=N)N)NC(=NC2CCCCC2)NC3CCCCC3

InChI

InChI=1S/C22H37N7O/c1-29-15-18(14-19(29)21(30)25-13-12-20(23)24)28-22(26-16-8-4-2-5-9-16)27-17-10-6-3-7-11-17/h14-17H,2-13H2,1H3,(H3,23,24)(H,25,30)(H2,26,27,28)