7-(1-benzothiophen-3-ylmethoxy)-6-chloranyl-2-piperazin-1-yl-4-pyrrolidin-1-yl-pteridine

Systemtic Name: 7-(1-benzothiophen-3-ylmethoxy)-6-chloranyl-2-piperazin-1-yl-4-pyrrolidin-1-yl-pteridine Openeye Name: 7-(benzothiophen-3-ylmethoxy)-6-chloro-2-piperazin-1-yl-4-pyrrolidin-1-yl-pteridine CAS Name: 7-(1-benzothiophen-3-ylmethoxy)-6-chloro-2-(1-piperazinyl)-4-(1-pyrrolidinyl)pteridine IUPAC Name: 7-(1-benzothiophen-3-ylmethoxy)-6-chloro-2-piperazin-1-yl-4-pyrrolidin-1-ylpteridine Traditional Name: 7-(benzothiophen-3-ylmethoxy)-6-chloro-2-piperazino-4-pyrrolidino-pteridine Formula: C23H24ClN7OS MolecularWeight: 482.00096

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC(=NC3=C2N=C(C(=N3)OCC4=CSC5=CC=CC=C54)Cl)N6CCNCC6

Isomeric SMILES

C1CCN(C1)C2=NC(=NC3=C2N=C(C(=N3)OCC4=CSC5=CC=CC=C54)Cl)N6CCNCC6

InChI

InChI=1S/C23H24ClN7OS/c24-19-22(32-13-15-14-33-17-6-2-1-5-16(15)17)27-20-18(26-19)21(30-9-3-4-10-30)29-23(28-20)31-11-7-25-8-12-31/h1-2,5-6,14,25H,3-4,7-13H2