N-[4-(4-carbamimidoylphenoxy)-6-methyl-pyrimidin-2-yl]cyclopentanecarboxamide

Systemtic Name: N-[4-(4-carbamimidoylphenoxy)-6-methyl-pyrimidin-2-yl]cyclopentanecarboxamide Openeye Name: N-[4-(4-carbamimidoylphenoxy)-6-methyl-pyrimidin-2-yl]cyclopentanecarboxamide CAS Name: N-[4-(4-carbamimidoylphenoxy)-6-methyl-2-pyrimidinyl]cyclopentanecarboxamide IUPAC Name: N-[4-(4-carbamimidoylphenoxy)-6-methylpyrimidin-2-yl]cyclopentanecarboxamide Traditional Name: N-[4-(4-amidinophenoxy)-6-methyl-pyrimidin-2-yl]cyclopentanecarboxamide Formula: C18H21N5O2 MolecularWeight: 339.39164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=O)C2CCCC2)OC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=O)C2CCCC2)OC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C18H21N5O2/c1-11-10-15(25-14-8-6-12(7-9-14)16(19)20)22-18(21-11)23-17(24)13-4-2-3-5-13/h6-10,13H,2-5H2,1H3,(H3,19,20)(H,21,22,23,24)