6-[[5-(3-phenylpyrrolidin-1-yl)sulfonylthiophen-2-yl]methyl]pyrrolo[3,4-b]pyridine-5,7-dione

Systemtic Name: 6-[[5-(3-phenylpyrrolidin-1-yl)sulfonylthiophen-2-yl]methyl]pyrrolo[3,4-b]pyridine-5,7-dione Openeye Name: 6-[[5-(3-phenylpyrrolidin-1-yl)sulfonyl-2-thienyl]methyl]pyrrolo[3,4-b]pyridine-5,7-dione CAS Name: 6-[[5-[(3-phenyl-1-pyrrolidinyl)sulfonyl]-2-thiophenyl]methyl]pyrrolo[3,4-b]pyridine-5,7-dione IUPAC Name: 6-[[5-(3-phenylpyrrolidin-1-yl)sulfonylthiophen-2-yl]methyl]pyrrolo[3,4-b]pyridine-5,7-dione Traditional Name: 6-[[5-(3-phenylpyrrolidino)sulfonyl-2-thienyl]methyl]pyrrolo[3,4-b]pyridine-5,7-quinone Formula: C22H19N3O4S2 MolecularWeight: 453.53396

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1C2=CC=CC=C2)S(=O)(=O)C3=CC=C(S3)CN4C(=O)C5=C(C4=O)N=CC=C5

Isomeric SMILES

C1CN(CC1C2=CC=CC=C2)S(=O)(=O)C3=CC=C(S3)CN4C(=O)C5=C(C4=O)N=CC=C5

InChI

InChI=1S/C22H19N3O4S2/c26-21-18-7-4-11-23-20(18)22(27)25(21)14-17-8-9-19(30-17)31(28,29)24-12-10-16(13-24)15-5-2-1-3-6-15/h1-9,11,16H,10,12-14H2