1-carbamimidoyl-2-phenyl-1-(phenylmethyl)guanidine hydrate

Systemtic Name: 1-carbamimidoyl-2-phenyl-1-(phenylmethyl)guanidine hydrate Openeye Name: 1-benzyl-1-carbamimidoyl-2-phenyl-guanidine hydrate CAS Name: 1-carbamimidoyl-2-phenyl-1-(phenylmethyl)guanidine hydrate IUPAC Name: 1-benzyl-1-carbamimidoyl-2-phenylguanidine hydrate Traditional Name: 1-amidino-1-benzyl-2-phenyl-guanidine hydrate Formula: C15H19N5O MolecularWeight: 285.34426

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(C(=N)N)C(=NC2=CC=CC=C2)N.O

Isomeric SMILES

C1=CC=C(C=C1)CN(C(=N)N)C(=NC2=CC=CC=C2)N.O

InChI

InChI=1S/C15H17N5.H2O/c16-14(17)20(11-12-7-3-1-4-8-12)15(18)19-13-9-5-2-6-10-13;/h1-10H,11H2,(H3,16,17)(H2,18,19);1H2