N-[cyano(methyl)carbamoyl]-4-(1H-imidazol-5-yl)-3-pentan-2-yl-benzamide

Systemtic Name: N-[cyano(methyl)carbamoyl]-4-(1H-imidazol-5-yl)-3-pentan-2-yl-benzamide Openeye Name: N-[cyano(methyl)carbamoyl]-4-(1H-imidazol-5-yl)-3-(1-methylbutyl)benzamide CAS Name: N-[[cyano(methyl)amino]-oxomethyl]-4-(1H-imidazol-5-yl)-3-pentan-2-ylbenzamide IUPAC Name: N-[cyano(methyl)carbamoyl]-4-(1H-imidazol-5-yl)-3-pentan-2-ylbenzamide Traditional Name: N-[cyano(methyl)carbamoyl]-4-(1H-imidazol-5-yl)-3-(1-methylbutyl)benzamide Formula: C18H21N5O2 MolecularWeight: 339.39164

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C1=C(C=CC(=C1)C(=O)NC(=O)N(C)C#N)C2=CN=CN2

Isomeric SMILES

CCCC(C)C1=C(C=CC(=C1)C(=O)NC(=O)N(C)C#N)C2=CN=CN2

InChI

InChI=1S/C18H21N5O2/c1-4-5-12(2)15-8-13(17(24)22-18(25)23(3)10-19)6-7-14(15)16-9-20-11-21-16/h6-9,11-12H,4-5H2,1-3H3,(H,20,21)(H,22,24,25)