3-(2-azanylpropan-2-yl)-N-[1-oxidanylidene-1-[3-oxidanylidene-3a-(phenylmethyl)-1,2,4,6,7,7a-hexahydropyrazolo[4,3-c]pyridin-5-yl]-3-phenylmethoxy-propan-2-yl]benzamide

Systemtic Name: 3-(2-azanylpropan-2-yl)-N-[1-oxidanylidene-1-[3-oxidanylidene-3a-(phenylmethyl)-1,2,4,6,7,7a-hexahydropyrazolo[4,3-c]pyridin-5-yl]-3-phenylmethoxy-propan-2-yl]benzamide Openeye Name: N-[2-(3a-benzyl-3-oxo-1,2,4,6,7,7a-hexahydropyrazolo[4,3-c]pyridin-5-yl)-1-(benzyloxymethyl)-2-oxo-ethyl]-3-(1-amino-1-methyl-ethyl)benzamide CAS Name: 3-(2-aminopropan-2-yl)-N-[1-oxo-1-[3-oxo-3a-(phenylmethyl)-1,2,4,6,7,7a-hexahydropyrazolo[4,3-c]pyridin-5-yl]-3-phenylmethoxypropan-2-yl]benzamide IUPAC Name: N-[1-(3a-benzyl-3-oxo-1,2,4,6,7,7a-hexahydropyrazolo[4,3-c]pyridin-5-yl)-1-oxo-3-phenylmethoxypropan-2-yl]-3-(2-aminopropan-2-yl)benzamide Traditional Name: N-[2-(3a-benzyl-3-keto-1,2,4,6,7,7a-hexahydropyrazolo[4,3-c]pyridin-5-yl)-1-(benzoxymethyl)-2-keto-ethyl]-3-(1-amino-1-methyl-ethyl)benzamide Formula: C33H39N5O4 MolecularWeight: 569.69386

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC(=C1)C(=O)NC(COCC2=CC=CC=C2)C(=O)N3CCC4C(C3)(C(=O)NN4)CC5=CC=CC=C5)N

Isomeric SMILES

CC(C)(C1=CC=CC(=C1)C(=O)NC(COCC2=CC=CC=C2)C(=O)N3CCC4C(C3)(C(=O)NN4)CC5=CC=CC=C5)N

InChI

InChI=1S/C33H39N5O4/c1-32(2,34)26-15-9-14-25(18-26)29(39)35-27(21-42-20-24-12-7-4-8-13-24)30(40)38-17-16-28-33(22-38,31(41)37-36-28)19-23-10-5-3-6-11-23/h3-15,18,27-28,36H,16-17,19-22,34H2,1-2H3,(H,35,39)(H,37,41)