N-(phenylmethyl)-2-piperazin-1-yl-4-pyrrolidin-1-yl-6-thiophen-2-yl-pteridin-7-amine

Systemtic Name: N-(phenylmethyl)-2-piperazin-1-yl-4-pyrrolidin-1-yl-6-thiophen-2-yl-pteridin-7-amine Openeye Name: N-benzyl-2-piperazin-1-yl-4-pyrrolidin-1-yl-6-(2-thienyl)pteridin-7-amine CAS Name: N-(phenylmethyl)-2-(1-piperazinyl)-4-(1-pyrrolidinyl)-6-thiophen-2-yl-7-pteridinamine IUPAC Name: N-benzyl-2-piperazin-1-yl-4-pyrrolidin-1-yl-6-thiophen-2-ylpteridin-7-amine Traditional Name: benzyl-[2-piperazino-4-pyrrolidino-6-(2-thienyl)pteridin-7-yl]amine Formula: C25H28N8S MolecularWeight: 472.60842

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC(=NC3=C2N=C(C(=N3)NCC4=CC=CC=C4)C5=CC=CS5)N6CCNCC6

Isomeric SMILES

C1CCN(C1)C2=NC(=NC3=C2N=C(C(=N3)NCC4=CC=CC=C4)C5=CC=CS5)N6CCNCC6

InChI

InChI=1S/C25H28N8S/c1-2-7-18(8-3-1)17-27-22-20(19-9-6-16-34-19)28-21-23(29-22)30-25(33-14-10-26-11-15-33)31-24(21)32-12-4-5-13-32/h1-3,6-9,16,26H,4-5,10-15,17H2,(H,27,29,30,31)