4-azanyl-N5-[2-(cyclopentylamino)-2-oxidanylidene-ethyl]-N5-[(4-methylphenyl)methyl]-1,2-oxazole-3,5-dicarboxamide

Systemtic Name: 4-azanyl-N5-[2-(cyclopentylamino)-2-oxidanylidene-ethyl]-N5-[(4-methylphenyl)methyl]-1,2-oxazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-[2-(cyclopentylamino)-2-oxo-ethyl]-N5-(p-tolylmethyl)isoxazole-3,5-dicarboxamide CAS Name: 4-amino-N5-[2-(cyclopentylamino)-2-oxoethyl]-N5-[(4-methylphenyl)methyl]isoxazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-[2-(cyclopentylamino)-2-oxoethyl]-5-N-[(4-methylphenyl)methyl]-1,2-oxazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-[2-(cyclopentylamino)-2-keto-ethyl]-N'-(4-methylbenzyl)isoxazole-3,5-dicarboxamide Formula: C20H25N5O4 MolecularWeight: 399.4436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(CC(=O)NC2CCCC2)C(=O)C3=C(C(=NO3)C(=O)N)N

Isomeric SMILES

CC1=CC=C(C=C1)CN(CC(=O)NC2CCCC2)C(=O)C3=C(C(=NO3)C(=O)N)N

InChI

InChI=1S/C20H25N5O4/c1-12-6-8-13(9-7-12)10-25(11-15(26)23-14-4-2-3-5-14)20(28)18-16(21)17(19(22)27)24-29-18/h6-9,14H,2-5,10-11,21H2,1H3,(H2,22,27)(H,23,26)