3-[(6-chloranyl-2-piperazin-1-yl-4-pyrrolidin-1-yl-pteridin-7-yl)oxymethyl]-1,2-oxazole

Systemtic Name: 3-[(6-chloranyl-2-piperazin-1-yl-4-pyrrolidin-1-yl-pteridin-7-yl)oxymethyl]-1,2-oxazole Openeye Name: 3-[(6-chloro-2-piperazin-1-yl-4-pyrrolidin-1-yl-pteridin-7-yl)oxymethyl]isoxazole CAS Name: 3-[[6-chloro-2-(1-piperazinyl)-4-(1-pyrrolidinyl)-7-pteridinyl]oxymethyl]isoxazole IUPAC Name: 3-[(6-chloro-2-piperazin-1-yl-4-pyrrolidin-1-ylpteridin-7-yl)oxymethyl]-1,2-oxazole Traditional Name: 3-[(6-chloro-2-piperazino-4-pyrrolidino-pteridin-7-yl)oxymethyl]isoxazole Formula: C18H21ClN8O2 MolecularWeight: 416.86474

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC(=NC3=C2N=C(C(=N3)OCC4=NOC=C4)Cl)N5CCNCC5

Isomeric SMILES

C1CCN(C1)C2=NC(=NC3=C2N=C(C(=N3)OCC4=NOC=C4)Cl)N5CCNCC5

InChI

InChI=1S/C18H21ClN8O2/c19-14-17(28-11-12-3-10-29-25-12)22-15-13(21-14)16(26-6-1-2-7-26)24-18(23-15)27-8-4-20-5-9-27/h3,10,20H,1-2,4-9,11H2