2-methyl-4-morpholin-4-yl-6-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile

Systemtic Name: 2-methyl-4-morpholin-4-yl-6-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile Openeye Name: 2-methyl-4-morpholino-6-(2-morpholino-2-oxo-ethyl)sulfanyl-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile CAS Name: 2-methyl-4-(4-morpholinyl)-6-[[2-(4-morpholinyl)-2-oxoethyl]thio]-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile IUPAC Name: 2-methyl-4-morpholin-4-yl-6-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile Traditional Name: 6-[(2-keto-2-morpholino-ethyl)thio]-2-methyl-4-morpholino-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile Formula: C18H22N6O3S MolecularWeight: 402.47068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=C(N2)SCC(=O)N3CCOCC3)C#N)C(=N1)N4CCOCC4

Isomeric SMILES

CC1=NC2=C(C(=C(N2)SCC(=O)N3CCOCC3)C#N)C(=N1)N4CCOCC4

InChI

InChI=1S/C18H22N6O3S/c1-12-20-16-15(17(21-12)24-4-8-27-9-5-24)13(10-19)18(22-16)28-11-14(25)23-2-6-26-7-3-23/h2-9,11H2,1H3,(H,20,21,22)