5-[(6-chloranyl-2-piperazin-1-yl-4-pyrrolidin-1-yl-pteridin-7-yl)oxymethyl]-1,3-thiazole

Systemtic Name: 5-[(6-chloranyl-2-piperazin-1-yl-4-pyrrolidin-1-yl-pteridin-7-yl)oxymethyl]-1,3-thiazole Openeye Name: 5-[(6-chloro-2-piperazin-1-yl-4-pyrrolidin-1-yl-pteridin-7-yl)oxymethyl]thiazole CAS Name: 5-[[6-chloro-2-(1-piperazinyl)-4-(1-pyrrolidinyl)-7-pteridinyl]oxymethyl]thiazole IUPAC Name: 5-[(6-chloro-2-piperazin-1-yl-4-pyrrolidin-1-ylpteridin-7-yl)oxymethyl]-1,3-thiazole Traditional Name: 5-[(6-chloro-2-piperazino-4-pyrrolidino-pteridin-7-yl)oxymethyl]thiazole Formula: C18H21ClN8OS MolecularWeight: 432.93034

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC(=NC3=C2N=C(C(=N3)OCC4=CN=CS4)Cl)N5CCNCC5

Isomeric SMILES

C1CCN(C1)C2=NC(=NC3=C2N=C(C(=N3)OCC4=CN=CS4)Cl)N5CCNCC5

InChI

InChI=1S/C18H21ClN8OS/c19-14-17(28-10-12-9-21-11-29-12)23-15-13(22-14)16(26-5-1-2-6-26)25-18(24-15)27-7-3-20-4-8-27/h9,11,20H,1-8,10H2