[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(1-pteridin-4-ylpiperidin-4-yl)methanone

Systemtic Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(1-pteridin-4-ylpiperidin-4-yl)methanone Openeye Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(1-pteridin-4-yl-4-piperidyl)methanone CAS Name: [4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-[1-(4-pteridinyl)-4-piperidinyl]methanone IUPAC Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(1-pteridin-4-ylpiperidin-4-yl)methanone Traditional Name: (4-piperonylpiperazino)-(1-pteridin-4-yl-4-piperidyl)methanone Formula: C24H27N7O3 MolecularWeight: 461.51628

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4)C5=NC=NC6=NC=CN=C65

Isomeric SMILES

C1CN(CCC1C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4)C5=NC=NC6=NC=CN=C65

InChI

InChI=1S/C24H27N7O3/c32-24(18-3-7-30(8-4-18)23-21-22(27-15-28-23)26-6-5-25-21)31-11-9-29(10-12-31)14-17-1-2-19-20(13-17)34-16-33-19/h1-2,5-6,13,15,18H,3-4,7-12,14,16H2