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

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-cyclopentyl-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-cyclopentyl-acetamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-cyclopentyl-2-[4-(phenylmethyl)-1-piperazinyl]acetamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-2-(4-benzylpiperazin-1-yl)-N-cyclopentylacetamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-2-(4-benzylpiperazino)-N-cyclopentyl-acetamide Formula: C26H38N6O3 MolecularWeight: 482.61832

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(C2CCCC2)C(=O)CN3CCN(CC3)CC4=CC=CC=C4)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(C2CCCC2)C(=O)CN3CCN(CC3)CC4=CC=CC=C4)N

InChI

InChI=1S/C26H38N6O3/c1-2-3-13-31-24(27)23(25(34)28-26(31)35)32(21-11-7-8-12-21)22(33)19-30-16-14-29(15-17-30)18-20-9-5-4-6-10-20/h4-6,9-10,21H,2-3,7-8,11-19,27H2,1H3,(H,28,34,35)