N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-pentyl-2-[4-(phenylmethyl)piperazin-1-yl]ethanamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-pentyl-2-[4-(phenylmethyl)piperazin-1-yl]ethanamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-2-(4-benzylpiperazin-1-yl)-N-pentyl-acetamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-pentyl-2-[4-(phenylmethyl)-1-piperazinyl]acetamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-2-(4-benzylpiperazin-1-yl)-N-pentylacetamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-amyl-2-(4-benzylpiperazino)acetamide Formula: C26H40N6O3 MolecularWeight: 484.6342

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(C1=C(N(C(=O)NC1=O)CCCC)N)C(=O)CN2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CCCCCN(C1=C(N(C(=O)NC1=O)CCCC)N)C(=O)CN2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C26H40N6O3/c1-3-5-10-14-31(23-24(27)32(13-6-4-2)26(35)28-25(23)34)22(33)20-30-17-15-29(16-18-30)19-21-11-8-7-9-12-21/h7-9,11-12H,3-6,10,13-20,27H2,1-2H3,(H,28,34,35)