2-[2-ethoxy-5-[2-pyrrolidin-1-ylethyl(sulfinato)amino]phenyl]-5-methyl-4-oxidanylidene-7-propyl-1H-pyrrolo[2,3-d]pyrimidine

Systemtic Name: 2-[2-ethoxy-5-[2-pyrrolidin-1-ylethyl(sulfinato)amino]phenyl]-5-methyl-4-oxidanylidene-7-propyl-1H-pyrrolo[2,3-d]pyrimidine Openeye Name: 2-[2-ethoxy-5-[2-pyrrolidin-1-ylethyl(sulfinato)amino]phenyl]-5-methyl-4-oxo-7-propyl-1H-pyrrolo[2,3-d]pyrimidine CAS Name: 2-[2-ethoxy-5-[2-(1-pyrrolidinyl)ethyl-sulfinatoamino]phenyl]-5-methyl-4-oxo-7-propyl-1H-pyrrolo[2,3-d]pyrimidine IUPAC Name: 2-[2-ethoxy-5-[2-pyrrolidin-1-ylethyl(sulfinato)amino]phenyl]-5-methyl-4-oxo-7-propyl-1H-pyrrolo[2,3-d]pyrimidine Traditional Name: 2-[2-ethoxy-5-[2-pyrrolidinoethyl(sulfinato)amino]phenyl]-4-keto-5-methyl-7-propyl-1H-pyrrolo[2,3-d]pyrimidine Formula: C24H32N5O4S- MolecularWeight: 486.60698

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C2=C1NC(=NC2=O)C3=C(C=CC(=C3)N(CCN4CCCC4)S(=O)[O-])OCC)C

Isomeric SMILES

CCCN1C=C(C2=C1NC(=NC2=O)C3=C(C=CC(=C3)N(CCN4CCCC4)S(=O)[O-])OCC)C

InChI

InChI=1S/C24H33N5O4S/c1-4-10-28-16-17(3)21-23(28)25-22(26-24(21)30)19-15-18(8-9-20(19)33-5-2)29(34(31)32)14-13-27-11-6-7-12-27/h8-9,15-16H,4-7,10-14H2,1-3H3,(H,31,32)(H,25,26,30)/p-1