N-(3-azanylpropyl)-N-[1-[5-bromanyl-2-oxidanylidene-3-(phenylmethyl)-1,3-oxazol-4-yl]-2-methyl-propyl]-4-methyl-benzamide

Systemtic Name: N-(3-azanylpropyl)-N-[1-[5-bromanyl-2-oxidanylidene-3-(phenylmethyl)-1,3-oxazol-4-yl]-2-methyl-propyl]-4-methyl-benzamide Openeye Name: N-(3-aminopropyl)-N-[1-(3-benzyl-5-bromo-2-oxo-oxazol-4-yl)-2-methyl-propyl]-4-methyl-benzamide CAS Name: N-(3-aminopropyl)-N-[1-[5-bromo-2-oxo-3-(phenylmethyl)-4-oxazolyl]-2-methylpropyl]-4-methylbenzamide IUPAC Name: N-(3-aminopropyl)-N-[1-(3-benzyl-5-bromo-2-oxo-1,3-oxazol-4-yl)-2-methylpropyl]-4-methylbenzamide Traditional Name: N-(3-aminopropyl)-N-[1-(3-benzyl-5-bromo-2-keto-4-oxazolin-4-yl)-2-methyl-propyl]-4-methyl-benzamide Formula: C25H30BrN3O3 MolecularWeight: 500.428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N(CCCN)C(C2=C(OC(=O)N2CC3=CC=CC=C3)Br)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N(CCCN)C(C2=C(OC(=O)N2CC3=CC=CC=C3)Br)C(C)C

InChI

InChI=1S/C25H30BrN3O3/c1-17(2)21(28(15-7-14-27)24(30)20-12-10-18(3)11-13-20)22-23(26)32-25(31)29(22)16-19-8-5-4-6-9-19/h4-6,8-13,17,21H,7,14-16,27H2,1-3H3