N-[2-[2-[(2,4-dimethylphenyl)methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl]-2-oxidanylidene-ethyl]-4-pyrrol-1-yl-benzamide

Systemtic Name: N-[2-[2-[(2,4-dimethylphenyl)methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl]-2-oxidanylidene-ethyl]-4-pyrrol-1-yl-benzamide Openeye Name: N-[2-[2-[(2,4-dimethylphenyl)methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl]-2-oxo-ethyl]-4-pyrrol-1-yl-benzamide CAS Name: N-[2-[2-[(2,4-dimethylphenyl)methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl]-2-oxoethyl]-4-(1-pyrrolyl)benzamide IUPAC Name: N-[2-[2-[(2,4-dimethylphenyl)methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl]-2-oxoethyl]-4-pyrrol-1-ylbenzamide Traditional Name: N-[2-[2-(2,4-dimethylbenzyl)-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl]-2-keto-ethyl]-4-pyrrol-1-yl-benzamide Formula: C28H32N4O2 MolecularWeight: 456.57928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CN2CC3CN(CC3C2)C(=O)CNC(=O)C4=CC=C(C=C4)N5C=CC=C5)C

Isomeric SMILES

CC1=CC(=C(C=C1)CN2CC3CN(CC3C2)C(=O)CNC(=O)C4=CC=C(C=C4)N5C=CC=C5)C

InChI

InChI=1S/C28H32N4O2/c1-20-5-6-23(21(2)13-20)15-30-16-24-18-32(19-25(24)17-30)27(33)14-29-28(34)22-7-9-26(10-8-22)31-11-3-4-12-31/h3-13,24-25H,14-19H2,1-2H3,(H,29,34)