6-chloranyl-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-piperazin-1-yl-4-pyrrolidin-1-yl-pteridin-7-amine

Systemtic Name: 6-chloranyl-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-piperazin-1-yl-4-pyrrolidin-1-yl-pteridin-7-amine Openeye Name: 6-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-piperazin-1-yl-4-pyrrolidin-1-yl-pteridin-7-amine CAS Name: 6-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-(1-piperazinyl)-4-(1-pyrrolidinyl)-7-pteridinamine IUPAC Name: 6-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-piperazin-1-yl-4-pyrrolidin-1-ylpteridin-7-amine Traditional Name: (6-chloro-2-piperazino-4-pyrrolidino-pteridin-7-yl)-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)amine Formula: C23H27ClN8O2 MolecularWeight: 482.96588

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC(=NC3=C2N=C(C(=N3)NCC4=CC5=C(C=C4)OCCO5)Cl)N6CCNCC6

Isomeric SMILES

C1CCN(C1)C2=NC(=NC3=C2N=C(C(=N3)NCC4=CC5=C(C=C4)OCCO5)Cl)N6CCNCC6

InChI

InChI=1S/C23H27ClN8O2/c24-19-21(26-14-15-3-4-16-17(13-15)34-12-11-33-16)28-20-18(27-19)22(31-7-1-2-8-31)30-23(29-20)32-9-5-25-6-10-32/h3-4,13,25H,1-2,5-12,14H2,(H,26,28,29,30)