1-carbamimidoyl-1-isoquinolin-1-yl-3-methyl-urea

Systemtic Name: 1-carbamimidoyl-1-isoquinolin-1-yl-3-methyl-urea Openeye Name: 1-carbamimidoyl-1-(1-isoquinolyl)-3-methyl-urea CAS Name: 1-carbamimidoyl-1-(1-isoquinolinyl)-3-methylurea IUPAC Name: 1-carbamimidoyl-1-isoquinolin-1-yl-3-methylurea Traditional Name: 1-amidino-1-(1-isoquinolyl)-3-methyl-urea Formula: C12H13N5O MolecularWeight: 243.26452

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)N(C1=NC=CC2=CC=CC=C21)C(=N)N

Isomeric SMILES

CNC(=O)N(C1=NC=CC2=CC=CC=C21)C(=N)N

InChI

InChI=1S/C12H13N5O/c1-15-12(18)17(11(13)14)10-9-5-3-2-4-8(9)6-7-16-10/h2-7H,1H3,(H3,13,14)(H,15,18)