3-azanyl-4-[1-(1H-imidazol-2-yl)ethyl]-5-(1H-imidazol-2-ylmethyl)-2-methyl-benzamide

Systemtic Name: 3-azanyl-4-[1-(1H-imidazol-2-yl)ethyl]-5-(1H-imidazol-2-ylmethyl)-2-methyl-benzamide Openeye Name: 3-amino-4-[1-(1H-imidazol-2-yl)ethyl]-5-(1H-imidazol-2-ylmethyl)-2-methyl-benzamide CAS Name: 3-amino-4-[1-(1H-imidazol-2-yl)ethyl]-5-(1H-imidazol-2-ylmethyl)-2-methylbenzamide IUPAC Name: 3-amino-4-[1-(1H-imidazol-2-yl)ethyl]-5-(1H-imidazol-2-ylmethyl)-2-methylbenzamide Traditional Name: 3-amino-4-[1-(1H-imidazol-2-yl)ethyl]-5-(1H-imidazol-2-ylmethyl)-2-methyl-benzamide Formula: C17H20N6O MolecularWeight: 324.3803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1C(=O)N)CC2=NC=CN2)C(C)C3=NC=CN3)N

Isomeric SMILES

CC1=C(C(=C(C=C1C(=O)N)CC2=NC=CN2)C(C)C3=NC=CN3)N

InChI

InChI=1S/C17H20N6O/c1-9-12(16(19)24)7-11(8-13-20-3-4-21-13)14(15(9)18)10(2)17-22-5-6-23-17/h3-7,10H,8,18H2,1-2H3,(H2,19,24)(H,20,21)(H,22,23)