6-azanyl-5-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]ethanoyl]-1-cyclopropyl-pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-5-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]ethanoyl]-1-cyclopropyl-pyrimidine-2,4-dione Openeye Name: 6-amino-5-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]acetyl]-1-cyclopropyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-[2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-1-oxoethyl]-1-cyclopropylpyrimidine-2,4-dione IUPAC Name: 6-amino-5-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]acetyl]-1-cyclopropylpyrimidine-2,4-dione Traditional Name: 6-amino-1-cyclopropyl-5-[2-(4-piperonylpiperazino)acetyl]pyrimidine-2,4-quinone Formula: C21H25N5O5 MolecularWeight: 427.4537

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=C(C(=O)NC2=O)C(=O)CN3CCN(CC3)CC4=CC5=C(C=C4)OCO5)N

Isomeric SMILES

C1CC1N2C(=C(C(=O)NC2=O)C(=O)CN3CCN(CC3)CC4=CC5=C(C=C4)OCO5)N

InChI

InChI=1S/C21H25N5O5/c22-19-18(20(28)23-21(29)26(19)14-2-3-14)15(27)11-25-7-5-24(6-8-25)10-13-1-4-16-17(9-13)31-12-30-16/h1,4,9,14H,2-3,5-8,10-12,22H2,(H,23,28,29)