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

Systemtic Name: N-[6-azanyl-2,4-bis(oxidanylidene)-1-propyl-pyrimidin-5-yl]-N-butyl-2-[(phenylmethyl)-prop-2-enyl-amino]ethanamide Openeye Name: 2-[allyl(benzyl)amino]-N-(6-amino-2,4-dioxo-1-propyl-pyrimidin-5-yl)-N-butyl-acetamide CAS Name: N-(6-amino-2,4-dioxo-1-propyl-5-pyrimidinyl)-N-butyl-2-[(phenylmethyl)-prop-2-enylamino]acetamide IUPAC Name: N-(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-2-[benzyl(prop-2-enyl)amino]-N-butylacetamide Traditional Name: 2-[allyl(benzyl)amino]-N-(6-amino-2,4-diketo-1-propyl-pyrimidin-5-yl)-N-butyl-acetamide Formula: C23H33N5O3 MolecularWeight: 427.53982

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=C(N(C(=O)NC1=O)CCC)N)C(=O)CN(CC=C)CC2=CC=CC=C2

Isomeric SMILES

CCCCN(C1=C(N(C(=O)NC1=O)CCC)N)C(=O)CN(CC=C)CC2=CC=CC=C2

InChI

InChI=1S/C23H33N5O3/c1-4-7-15-27(20-21(24)28(14-6-3)23(31)25-22(20)30)19(29)17-26(13-5-2)16-18-11-9-8-10-12-18/h5,8-12H,2,4,6-7,13-17,24H2,1,3H3,(H,25,30,31)