N-[(4-carbamimidoylphenyl)methyl]-2-ethoxy-2-(3-phenylpyrazol-1-yl)ethanamide

Systemtic Name: N-[(4-carbamimidoylphenyl)methyl]-2-ethoxy-2-(3-phenylpyrazol-1-yl)ethanamide Openeye Name: N-[(4-carbamimidoylphenyl)methyl]-2-ethoxy-2-(3-phenylpyrazol-1-yl)acetamide CAS Name: N-[(4-carbamimidoylphenyl)methyl]-2-ethoxy-2-(3-phenyl-1-pyrazolyl)acetamide IUPAC Name: N-[(4-carbamimidoylphenyl)methyl]-2-ethoxy-2-(3-phenylpyrazol-1-yl)acetamide Traditional Name: N-(4-amidinobenzyl)-2-ethoxy-2-(3-phenylpyrazol-1-yl)acetamide Formula: C21H23N5O2 MolecularWeight: 377.43962

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C(=O)NCC1=CC=C(C=C1)C(=N)N)N2C=CC(=N2)C3=CC=CC=C3

Isomeric SMILES

CCOC(C(=O)NCC1=CC=C(C=C1)C(=N)N)N2C=CC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C21H23N5O2/c1-2-28-21(26-13-12-18(25-26)16-6-4-3-5-7-16)20(27)24-14-15-8-10-17(11-9-15)19(22)23/h3-13,21H,2,14H2,1H3,(H3,22,23)(H,24,27)