7-pentan-3-yl-2-[(4-piperidin-1-ylphenyl)amino]-5H-pyrrolo[2,3-d]pyrimidin-6-one

Systemtic Name: 7-pentan-3-yl-2-[(4-piperidin-1-ylphenyl)amino]-5H-pyrrolo[2,3-d]pyrimidin-6-one Openeye Name: 7-(1-ethylpropyl)-2-[4-(1-piperidyl)anilino]-5H-pyrrolo[2,3-d]pyrimidin-6-one CAS Name: 7-pentan-3-yl-2-[4-(1-piperidinyl)anilino]-5H-pyrrolo[2,3-d]pyrimidin-6-one IUPAC Name: 7-pentan-3-yl-2-(4-piperidin-1-ylanilino)-5H-pyrrolo[2,3-d]pyrimidin-6-one Traditional Name: 7-(1-ethylpropyl)-2-(4-piperidinoanilino)-5H-pyrrolo[2,3-d]pyrimidin-6-one Formula: C22H29N5O MolecularWeight: 379.49856

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N1C(=O)CC2=CN=C(N=C21)NC3=CC=C(C=C3)N4CCCCC4

Isomeric SMILES

CCC(CC)N1C(=O)CC2=CN=C(N=C21)NC3=CC=C(C=C3)N4CCCCC4

InChI

InChI=1S/C22H29N5O/c1-3-18(4-2)27-20(28)14-16-15-23-22(25-21(16)27)24-17-8-10-19(11-9-17)26-12-6-5-7-13-26/h8-11,15,18H,3-7,12-14H2,1-2H3,(H,23,24,25)