2-(1-azanyl-2-methyl-butyl)-N-[4-methyl-1-[(4-nitrophenyl)amino]-1-oxidanylidene-pentan-2-yl]-1,3-oxazole-4-carboxamide

Systemtic Name: 2-(1-azanyl-2-methyl-butyl)-N-[4-methyl-1-[(4-nitrophenyl)amino]-1-oxidanylidene-pentan-2-yl]-1,3-oxazole-4-carboxamide Openeye Name: 2-(1-amino-2-methyl-butyl)-N-[3-methyl-1-[(4-nitrophenyl)carbamoyl]butyl]oxazole-4-carboxamide CAS Name: 2-(1-amino-2-methylbutyl)-N-[4-methyl-1-(4-nitroanilino)-1-oxopentan-2-yl]-4-oxazolecarboxamide IUPAC Name: 2-(1-amino-2-methylbutyl)-N-[4-methyl-1-(4-nitroanilino)-1-oxopentan-2-yl]-1,3-oxazole-4-carboxamide Traditional Name: 2-(1-amino-2-methyl-butyl)-N-[3-methyl-1-[(4-nitrophenyl)carbamoyl]butyl]oxazole-4-carboxamide Formula: C21H29N5O5 MolecularWeight: 431.48546

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C1=NC(=CO1)C(=O)NC(CC(C)C)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-])N

Isomeric SMILES

CCC(C)C(C1=NC(=CO1)C(=O)NC(CC(C)C)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-])N

InChI

InChI=1S/C21H29N5O5/c1-5-13(4)18(22)21-25-17(11-31-21)20(28)24-16(10-12(2)3)19(27)23-14-6-8-15(9-7-14)26(29)30/h6-9,11-13,16,18H,5,10,22H2,1-4H3,(H,23,27)(H,24,28)