N-[[5-azanyl-1-(phenylmethyl)imidazol-4-yl]-cyano-methylidene]ethanamide

Systemtic Name: N-[[5-azanyl-1-(phenylmethyl)imidazol-4-yl]-cyano-methylidene]ethanamide Openeye Name: N-acetyl-5-amino-1-benzyl-imidazole-4-carboximidoyl cyanide CAS Name: N-[[5-amino-1-(phenylmethyl)-4-imidazolyl]-cyanomethylidene]acetamide IUPAC Name: N-acetyl-5-amino-1-benzylimidazole-4-carboximidoyl cyanide Traditional Name: N-[(5-amino-1-benzyl-imidazol-4-yl)-cyano-methylene]acetamide Formula: C14H13N5O MolecularWeight: 267.28592

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N=C(C#N)C1=C(N(C=N1)CC2=CC=CC=C2)N

Isomeric SMILES

CC(=O)N=C(C#N)C1=C(N(C=N1)CC2=CC=CC=C2)N

InChI

InChI=1S/C14H13N5O/c1-10(20)18-12(7-15)13-14(16)19(9-17-13)8-11-5-3-2-4-6-11/h2-6,9H,8,16H2,1H3