N-[1-(3-azanyl-3-oxidanylidene-propyl)-5-(1-cyclopropyl-2-methyl-1-oxidanylidene-propan-2-yl)benzimidazol-2-yl]-1,2-oxazole-5-carboxamide

Systemtic Name: N-[1-(3-azanyl-3-oxidanylidene-propyl)-5-(1-cyclopropyl-2-methyl-1-oxidanylidene-propan-2-yl)benzimidazol-2-yl]-1,2-oxazole-5-carboxamide Openeye Name: N-[1-(3-amino-3-oxo-propyl)-5-(2-cyclopropyl-1,1-dimethyl-2-oxo-ethyl)benzimidazol-2-yl]isoxazole-5-carboxamide CAS Name: N-[1-(3-amino-3-oxopropyl)-5-(1-cyclopropyl-2-methyl-1-oxopropan-2-yl)-2-benzimidazolyl]-5-isoxazolecarboxamide IUPAC Name: N-[1-(3-amino-3-oxopropyl)-5-(1-cyclopropyl-2-methyl-1-oxopropan-2-yl)benzimidazol-2-yl]-1,2-oxazole-5-carboxamide Traditional Name: N-[1-(3-amino-3-keto-propyl)-5-(2-cyclopropyl-2-keto-1,1-dimethyl-ethyl)benzimidazol-2-yl]isoxazole-5-carboxamide Formula: C21H23N5O4 MolecularWeight: 409.43842

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC2=C(C=C1)N(C(=N2)NC(=O)C3=CC=NO3)CCC(=O)N)C(=O)C4CC4

Isomeric SMILES

CC(C)(C1=CC2=C(C=C1)N(C(=N2)NC(=O)C3=CC=NO3)CCC(=O)N)C(=O)C4CC4

InChI

InChI=1S/C21H23N5O4/c1-21(2,18(28)12-3-4-12)13-5-6-15-14(11-13)24-20(26(15)10-8-17(22)27)25-19(29)16-7-9-23-30-16/h5-7,9,11-12H,3-4,8,10H2,1-2H3,(H2,22,27)(H,24,25,29)