6-[4-azanyl-3-[(3-methylphenyl)methyl]-2,6-bis(oxidanylidene)pyrimidin-1-yl]hexan-2-yl ethanoate

Systemtic Name: 6-[4-azanyl-3-[(3-methylphenyl)methyl]-2,6-bis(oxidanylidene)pyrimidin-1-yl]hexan-2-yl ethanoate Openeye Name: [5-[4-amino-3-(m-tolylmethyl)-2,6-dioxo-pyrimidin-1-yl]-1-methyl-pentyl] acetate CAS Name: acetic acid 6-[4-amino-3-[(3-methylphenyl)methyl]-2,6-dioxo-1-pyrimidinyl]hexan-2-yl ester IUPAC Name: 6-[4-amino-3-[(3-methylphenyl)methyl]-2,6-dioxopyrimidin-1-yl]hexan-2-yl acetate Traditional Name: acetic acid [5-[4-amino-2,6-diketo-3-(3-methylbenzyl)pyrimidin-1-yl]-1-methyl-pentyl] ester Formula: C20H27N3O4 MolecularWeight: 373.44608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C(=CC(=O)N(C2=O)CCCCC(C)OC(=O)C)N

Isomeric SMILES

CC1=CC(=CC=C1)CN2C(=CC(=O)N(C2=O)CCCCC(C)OC(=O)C)N

InChI

InChI=1S/C20H27N3O4/c1-14-7-6-9-17(11-14)13-23-18(21)12-19(25)22(20(23)26)10-5-4-8-15(2)27-16(3)24/h6-7,9,11-12,15H,4-5,8,10,13,21H2,1-3H3