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

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-cyclopentyl-2-[(phenylmethyl)-prop-2-enyl-amino]ethanamide Openeye Name: 2-[allyl(benzyl)amino]-N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-cyclopentyl-acetamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-cyclopentyl-2-[(phenylmethyl)-prop-2-enylamino]acetamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-2-[benzyl(prop-2-enyl)amino]-N-cyclopentylacetamide Traditional Name: 2-[allyl(benzyl)amino]-N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-cyclopentyl-acetamide Formula: C25H35N5O3 MolecularWeight: 453.5771

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(C2CCCC2)C(=O)CN(CC=C)CC3=CC=CC=C3)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(C2CCCC2)C(=O)CN(CC=C)CC3=CC=CC=C3)N

InChI

InChI=1S/C25H35N5O3/c1-3-5-16-29-23(26)22(24(32)27-25(29)33)30(20-13-9-10-14-20)21(31)18-28(15-4-2)17-19-11-7-6-8-12-19/h4,6-8,11-12,20H,2-3,5,9-10,13-18,26H2,1H3,(H,27,32,33)