1-carbamimidoyl-1-[(3-chloranylpyridin-2-yl)methyl]-3-pentyl-urea

Systemtic Name: 1-carbamimidoyl-1-[(3-chloranylpyridin-2-yl)methyl]-3-pentyl-urea Openeye Name: 1-carbamimidoyl-1-[(3-chloro-2-pyridyl)methyl]-3-pentyl-urea CAS Name: 1-carbamimidoyl-1-[(3-chloro-2-pyridinyl)methyl]-3-pentylurea IUPAC Name: 1-carbamimidoyl-1-[(3-chloropyridin-2-yl)methyl]-3-pentylurea Traditional Name: 1-amidino-3-amyl-1-[(3-chloro-2-pyridyl)methyl]urea Formula: C13H20ClN5O MolecularWeight: 297.7838

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)N(CC1=C(C=CC=N1)Cl)C(=N)N

Isomeric SMILES

CCCCCNC(=O)N(CC1=C(C=CC=N1)Cl)C(=N)N

InChI

InChI=1S/C13H20ClN5O/c1-2-3-4-7-18-13(20)19(12(15)16)9-11-10(14)6-5-8-17-11/h5-6,8H,2-4,7,9H2,1H3,(H3,15,16)(H,18,20)